Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)c(O)ccc2 0.896 0.338 0.193 0.811 0.827 0.729 0.944 0.764 0.483 0.967 0.918 Compound_2 O=Cc1ccc(c(c1O)c1ccccc1)c1ccccc1 0.828 0.748 0.169 0.739 0.836 0.973 0.972 0.803 0.574 0.628 0.746 Compound_3 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)Cl)O 0.575 0.569 0.046 0.547 0.977 0.645 0.073 0.871 0.166 0.981 0.649 Compound_4 CON=Cc1ccc(c(c1O)c1ccccc1)c1ccccc1 0.754 0.676 0.438 0.741 0.84 0.963 0.269 0.84 0.587 0.937 0.897 Compound_5 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccccc1 0.821 0.841 0.331 0.596 0.993 0.997 0.261 0.884 0.842 0.957 0.973 Compound_6 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C2=C1c1ccc(cc1OCC2)O)O 0.642 0.652 0.269 0.532 0.951 0.629 0.254 0.827 0.242 0.964 0.477 Compound_7 CC#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.967 0.973 0.021 0.394 0.989 0.993 0.067 0.105 0.125 0.998 0.918 Compound_8 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(c(c2C(=C1c1ccc(cc1)F)C)Cl)O 0.596 0.609 0.249 0.569 0.933 0.626 0.599 0.909 0.336 0.47 0.465 Compound_9 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.541 0.573 0.304 0.531 0.961 0.567 0.048 0.912 0.158 0.857 0.541 Compound_10 Oc1ccc2c(c1)CCC1C2C(CC2(C1CCC2O)C)c1ccc(cc1)OCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F 0.779 0.809 0.437 0.587 0.989 0.933 0.724 0.472 0.38 0.995 0.592 Compound_11 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(O)ccc2C2=C1c1ccc(cc1OCC2)O 0.606 0.652 0.193 0.56 0.94 0.619 0.324 0.677 0.255 0.964 0.477 Compound_12 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)Cl 0.934 0.439 0.352 0.746 0.888 0.732 0.858 0.835 0.455 0.478 0.836 Compound_13 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(O)cccc2C(=C1c1cccc(c1)O)C 0.5 0.56 0.283 0.541 0.907 0.359 0.05 0.912 0.139 0.735 0.492 Compound_14 FCC1CCN(C1)C(COc1ccc(cc1)C1Oc2cc(O)ccc2C2=C1c1ccc(cc1OCC2)O)C 0.598 0.763 0.525 0.517 0.951 0.771 0.073 0.747 0.262 0.946 0.481 Compound_15 CCC1c2cc(O)ccc2C(=C1c1ccc(cc1)O)CC 0.637 0.733 0.082 0.555 0.97 0.74 0.781 0.974 0.47 0.997 1.001 Compound_16 O=S(CCCC(C(F)(F)F)(F)F)CCCCCCCCCC1Cc2cc(O)ccc2C2C1C1CCC(C1(CC2)C)O 0.885 0.814 0.064 0.861 0.989 0.936 0.11 0.638 0.312 0.997 0.602 Compound_17 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1C1CCCCC1)C)O 0.64 0.6 0.313 0.526 0.93 0.608 0.072 0.944 0.38 0.229 0.483 Compound_18 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cc(cc1C)Cl 0.627 0.662 0.949 0.544 0.907 0.719 0.963 0.96 0.579 0.88 0.879 Compound_19 FCC1CCN(C1)CCOc1ccc(cc1)C1Oc2cc(O)ccc2C2=C1c1ccc(cc1OCC2)O 0.616 0.695 0.459 0.525 0.96 0.729 0.151 0.617 0.272 0.986 0.385 Compound_20 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.466 0.658 0.312 0.472 0.887 0.671 0.943 0.732 0.446 0.922 0.473 Compound_21 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1c[nH]nc1)C)O 0.612 0.599 0.023 0.483 0.859 0.66 0.068 0.852 0.382 0.061 0.45 Compound_22 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O)C 0.492 0.796 0.448 0.427 0.969 0.807 0.026 0.83 0.153 0.947 0.899 Compound_23 CCCc1c(nn(c1c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.307 0.589 0.535 0.714 0.987 0.94 0.794 0.873 0.819 0.158 0.855 Compound_24 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)F)C)O 0.529 0.619 0.461 0.568 0.967 0.567 0.477 0.947 0.336 0.215 0.368 Compound_25 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)O)C)O)C 0.516 0.796 0.505 0.486 0.969 0.807 0.026 0.881 0.22 0.947 0.899 Compound_26 FCC1CCN(CC1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.537 0.668 0.272 0.495 0.96 0.743 0.117 0.901 0.23 0.857 0.584 Compound_27 FCC1CCN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.555 0.648 0.393 0.502 0.977 0.696 0.068 0.901 0.188 0.941 0.646 Compound_28 FCC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O)C 0.533 0.746 0.513 0.486 0.974 0.787 0.028 0.908 0.163 0.815 0.836 Compound_29 CCC(C(c1ccc(cc1)O)CC)c1ccc(cn1)O 0.276 0.742 0.257 0.494 0.366 0.686 0.018 0.729 0.274 0.21 0.906 Compound_30 CCC(C(c1ccc(cc1)O)C)c1ccc(cn1)O 0.263 0.721 0.149 0.492 0.366 0.686 0.018 0.729 0.267 0.104 0.872 Compound_31 CCCn1c(cc(c1c1ccc(cc1F)O)c1ccc(cc1)O)c1ccc(cc1)O 0.725 0.524 0.666 0.746 0.982 0.979 0.942 0.972 0.899 0.041 0.489 Compound_32 OCCN(C(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)CCO 0.781 0.548 0.36 0.677 0.939 0.992 0.813 0.657 0.41 0.608 0.204 Compound_33 ON=Cc1ccc(c(c1)c1ccccc1)c1ccccc1 0.81 0.566 0.922 0.707 0.584 0.929 0.968 0.823 0.635 0.944 0.901 Compound_34 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.88 0.828 0.302 0.593 0.993 0.997 0.261 0.95 0.811 0.939 0.961 Compound_35 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1C1CCC(CC1)(F)F)C)O 0.636 0.624 0.577 0.536 0.962 0.595 0.82 0.948 0.289 0.156 0.488 Compound_36 OCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.678 0.587 0.027 0.505 0.923 0.974 0.682 0.55 0.453 0.128 0.243 Compound_37 COc1cc(C=CC(=O)O)cc(c1C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1)F 0.556 0.668 0.894 0.482 0.879 0.699 0.998 0.666 0.534 0.341 0.599 Compound_38 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccnc1 0.505 0.593 0.286 0.482 0.809 0.604 0.063 0.881 0.183 0.793 0.428 Compound_39 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccncc1 0.445 0.593 0.231 0.514 0.809 0.604 0.063 0.907 0.341 0.793 0.428 Compound_40 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.517 0.678 0.246 0.488 0.952 0.656 0.043 0.705 0.203 0.821 0.5 Compound_41 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1Cl)Cl 0.478 0.628 0.229 0.378 0.986 0.882 0.392 0.884 0.485 0.612 0.534 Compound_42 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1F)OC(F)F 0.499 0.592 0.187 0.53 0.988 0.696 0.81 0.959 0.273 0.62 0.373 Compound_43 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCCCC1)C)ccc(c2)O 0.494 0.756 0.377 0.451 0.947 0.755 0.025 0.757 0.172 0.558 0.785 Compound_44 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1CCC(CC1)O 0.618 0.619 0.215 0.403 0.889 0.786 0.051 0.903 0.235 0.701 0.351 Compound_45 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)OC 0.5 0.634 0.466 0.514 0.961 0.862 0.081 0.951 0.266 0.106 0.443 Compound_46 CC1CCN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.515 0.729 0.305 0.479 0.972 0.725 0.064 0.836 0.173 0.808 0.772 Compound_47 FCC1CN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O)C 0.518 0.656 0.47 0.475 0.959 0.563 0.021 0.911 0.147 0.693 0.698 Compound_48 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)Cl 0.558 0.621 0.613 0.507 0.984 0.799 0.564 0.971 0.346 0.836 0.615 Compound_49 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2cc(O)ccc2C(=C1c1cccc(c1)O)C)C 0.561 0.818 0.448 0.438 0.955 0.843 0.056 0.83 0.166 0.912 0.893 Compound_50 CCCN1CC(C1)Oc1ccc(cc1)C1=C(CCc2c1cc(O)cc2)c1ccc(cc1)O 0.482 0.594 0.289 0.471 0.907 0.647 0.016 0.639 0.38 0.426 0.579 Compound_51 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCCN1CCCCCC1)ccc(c2)O 0.524 0.665 0.246 0.488 0.967 0.717 0.048 0.705 0.298 0.821 0.488 Compound_52 CCCn1c(cc(c1c1ccc(cc1F)O)c1ccc(cc1F)O)c1ccc(cc1F)O 0.73 0.524 0.666 0.736 0.99 0.974 0.983 0.972 0.84 0.041 0.489 Compound_53 CC1CCN(CC1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.517 0.727 0.305 0.521 0.952 0.77 0.109 0.839 0.214 0.606 0.536 Compound_54 FCC1CCCN1CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.556 0.668 0.195 0.522 0.967 0.67 0.024 0.807 0.205 0.954 0.743 Compound_55 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(c(c2C(=C1c1ccc(cc1)F)C)F)O 0.58 0.619 0.249 0.569 0.967 0.567 0.477 0.909 0.335 0.215 0.368 Compound_56 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(F)(F)C 0.856 0.638 0.77 0.639 0.941 0.73 0.975 0.919 0.794 0.964 0.762 Compound_57 Oc1ccc(cc1)C(=O)c1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.772 0.637 0.908 0.755 0.924 0.814 0.985 0.989 0.811 0.913 0.667 Compound_58 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C(F)(F)C)F 0.828 0.628 0.955 0.571 0.935 0.724 0.975 0.916 0.749 0.961 0.68 Compound_59 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCCN1CCC(C1)C(F)F)ccc(c2)O 0.561 0.628 0.272 0.488 0.99 0.658 0.811 0.937 0.187 0.941 0.637 Compound_60 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)C#N)C)O 0.599 0.648 0.292 0.576 0.966 0.55 0.102 0.943 0.341 0.225 0.623 Compound_61 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCCCCC1)C)ccc(c2)O 0.505 0.752 0.377 0.451 0.966 0.708 0.02 0.757 0.28 0.558 0.76 Compound_62 COCC=CC1=C(C)c2c(OC1c1ccc(cc1)OCCN1CC(C1)CF)ccc(c2)O 0.649 0.671 0.435 0.518 0.899 0.529 0.054 0.981 0.368 0.201 0.479 Compound_63 C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.981 0.993 0.013 0.367 0.984 0.961 0.067 0.082 0.124 0.998 0.918 Compound_64 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cc(cc1C)F 0.656 0.643 0.949 0.544 0.888 0.738 0.992 0.96 0.603 0.898 0.792 Compound_65 OC(=O)C=Cc1ccc2c(c1)CCC1C2CCC2(C1CCC2O)C 0.889 0.91 0.009 0.347 0.957 0.972 0.417 0.86 0.518 0.988 0.289 Compound_66 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C2=C1c1cc(O)ccc1OCC2)O 0.613 0.592 0.269 0.532 0.95 0.604 0.167 0.827 0.207 0.98 0.491 Compound_67 OC(=O)C=Cc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1ccc(c2)O 0.456 0.66 0.144 0.406 0.738 0.786 0.145 0.876 0.482 0.333 0.169 Compound_68 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1(C)N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.525 0.718 0.774 0.486 0.874 0.675 0.937 0.743 0.472 0.875 0.526 Compound_69 OC(=O)C=Cc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.471 0.714 0.219 0.358 0.861 0.681 0.998 0.557 0.468 0.339 0.282 Compound_70 CC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1C 0.518 0.562 0.742 0.586 0.83 0.652 0.945 0.797 0.358 0.847 0.553 Compound_71 NC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.898 0.658 0.023 0.517 0.978 0.995 0.891 0.91 0.474 0.813 0.92 Compound_72 CCCn1c(cc(c1c1ccc(cc1F)O)c1ccc(cc1)O)c1ccc(cc1F)O 0.715 0.524 0.666 0.745 0.99 0.974 0.983 0.963 0.899 0.041 0.489 Compound_73 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1C1CCC(CC1)O)C)O 0.65 0.586 0.07 0.501 0.911 0.563 0.038 0.928 0.317 0.877 0.512 Compound_74 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(nc1)N)C)O 0.583 0.578 0.294 0.466 0.812 0.499 0.045 0.885 0.206 0.126 0.62 Compound_75 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2C(C1)CCC2 0.499 0.51 0.161 0.539 0.904 0.688 0.014 0.526 0.215 0.976 0.884 Compound_76 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCCN1CCC1)ccc(c2)O 0.505 0.573 0.358 0.519 0.954 0.577 0.03 0.795 0.14 0.821 0.5 Compound_77 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCc2c1cc(O)cc2)c1ccc(cc1)O 0.473 0.633 0.283 0.542 0.952 0.842 0.058 0.948 0.281 0.693 0.649 Compound_78 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2cc(O)ccc2C(=C1c1ccc(cc1)O)C)C 0.497 0.818 0.397 0.517 0.953 0.855 0.04 0.68 0.261 0.912 0.893 Compound_79 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)F 0.583 0.621 0.613 0.507 0.989 0.766 0.577 0.971 0.412 0.836 0.615 Compound_80 CCOc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1 0.74 0.655 0.688 0.644 0.995 0.96 0.708 0.962 0.377 0.88 0.941 Compound_81 Fc1cc(F)c2c(c1)c1ccc3c(c1C(O2)c1ccc(cc1)OCCN1CCCCC1)ccc(c3)O 0.318 0.588 0.738 0.615 0.951 0.818 0.507 0.943 0.443 0.546 0.415 Compound_82 COCC1CCN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.521 0.717 0.134 0.494 0.973 0.797 0.086 0.679 0.218 0.419 0.719 Compound_83 COc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1 0.768 0.724 0.656 0.645 0.989 0.95 0.715 0.709 0.77 0.892 0.889 Compound_84 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(F)C 0.822 0.641 0.77 0.664 0.925 0.737 0.986 0.905 0.665 0.934 0.619 Compound_85 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)oc(n2)C 0.467 0.721 0.95 0.568 0.842 0.651 0.995 0.983 0.202 0.664 0.373 Compound_86 COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)CCC1(O)CC(C1)Oc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.652 0.649 0.555 0.422 0.932 0.656 0.99 0.49 0.404 0.148 0.591 Compound_87 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCCC1)C)ccc(c2)O 0.492 0.746 0.377 0.471 0.969 0.702 0.022 0.68 0.173 0.771 0.838 Compound_88 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1cc(O)cc2)c1ccc(cc1Cl)F 0.579 0.615 0.613 0.507 0.989 0.766 0.577 0.971 0.419 0.844 0.714 Compound_89 CC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.505 0.645 0.34 0.54 0.956 0.58 0.045 0.772 0.142 0.652 0.554 Compound_90 COc1ccc(c(c1)Cl)C(=C(c1ccc2n(c1)ccn2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.694 0.605 0.202 0.446 0.853 0.663 0.972 0.479 0.366 0.5 0.596 Compound_91 CCC1=C(Cc2c1ccc(c2)O)c1ccc(cc1)O 0.581 0.653 0.409 0.524 0.969 0.738 0.724 0.954 0.552 0.997 0.999 Compound_92 CCCn1c(cc(c1c1ccc(cc1Cl)O)c1ccc(cc1)O)c1ccc(cc1)O 0.759 0.536 0.666 0.746 0.986 0.91 0.923 0.972 0.885 0.104 0.773 Compound_93 COc1cc(C=CC(=O)O)c(cc1C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1)F 0.576 0.668 0.894 0.459 0.879 0.699 0.998 0.635 0.532 0.341 0.599 Compound_94 OC(=O)C=Cc1cc(F)c(c(c1)F)C1(C)N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.476 0.737 0.557 0.409 0.884 0.679 0.998 0.577 0.466 0.31 0.371 Compound_95 OC(=O)C=Cc1ccc(cc1)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.505 0.734 0.335 0.297 0.843 0.68 0.995 0.564 0.53 0.267 0.371 Compound_96 NCCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.592 0.568 0.014 0.367 0.905 0.991 0.453 0.513 0.44 0.014 0.162 Compound_97 CN(CCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)C 0.706 0.622 0.006 0.387 0.88 0.982 0.218 0.785 0.464 0.018 0.146 Compound_98 CCc1c(oc(c1c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCCC1 0.07 0.466 0.767 0.761 0.636 0.883 0.943 0.891 0.604 0.618 0.6 Compound_99 OCCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.614 0.604 0.016 0.533 0.897 0.991 0.587 0.587 0.42 0.138 0.144 Compound_100 NCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.625 0.595 0.014 0.414 0.909 0.991 0.473 0.513 0.446 0.008 0.16 Compound_101 OCCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.971 0.523 0.068 0.747 0.997 0.995 0.967 0.89 0.429 0.957 0.735 Compound_102 OCCN(C(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)C 0.785 0.615 0.418 0.664 0.93 0.991 0.401 0.739 0.406 0.019 0.097 Compound_103 FCC(CN1C(C)Cc2c(C1c1c(F)cc(cc1F)C=CC(=O)O)ccc(c2)O)C 0.471 0.636 0.1 0.426 0.743 0.799 0.185 0.936 0.477 0.057 0.117 Compound_104 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1Cl)F 0.648 0.679 0.867 0.448 0.937 0.713 1.0 0.267 0.703 0.742 0.847 Compound_105 COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)CCCCCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.638 0.625 0.448 0.47 0.913 0.737 0.992 0.408 0.404 0.396 0.574 Compound_106 CCCNS(=O)(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.835 0.558 0.105 0.597 0.903 0.984 0.208 0.988 0.39 0.164 0.438 Compound_107 OC(=O)C=Cc1cc(F)c(c(c1)F)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.478 0.686 0.428 0.405 0.898 0.677 0.998 0.831 0.461 0.014 0.274 Compound_108 OC(=O)C=Cc1cc(F)c(c(c1)F)C1(C)N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.47 0.727 0.346 0.373 0.842 0.683 0.998 0.242 0.473 0.339 0.313 Compound_109 OC(=O)C=Cc1cc(F)c(c(c1)F)C1(C)N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.445 0.687 0.497 0.358 0.899 0.737 0.994 0.36 0.482 0.431 0.277 Compound_110 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.802 0.769 0.61 0.644 0.928 0.743 0.992 0.86 0.6 0.899 0.509 Compound_111 FCC(CN1C(C)Cc2c(C1c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.524 0.7 0.257 0.395 0.646 0.841 0.033 0.929 0.545 0.056 0.191 Compound_112 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)F)C)O)C 0.491 0.796 0.72 0.485 0.969 0.786 0.016 0.94 0.327 0.483 0.606 Compound_113 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C1CC1 0.765 0.688 0.089 0.447 0.982 0.909 0.767 0.904 0.535 0.009 0.526 Compound_114 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1cc(O)cc2)c1ccc(cc1)O 0.49 0.62 0.283 0.534 0.959 0.87 0.062 0.974 0.278 0.693 0.601 Compound_115 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2(C1)CCC2 0.459 0.513 0.176 0.563 0.809 0.652 0.022 0.448 0.275 0.826 0.708 Compound_116 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCCN1CCCC1)ccc(c2)O 0.515 0.689 0.246 0.508 0.971 0.723 0.055 0.616 0.199 0.925 0.59 Compound_117 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1F)CC(C)C 0.774 0.632 0.172 0.442 0.979 0.945 0.807 0.926 0.649 0.234 0.215 Compound_118 O=C(C1CCCCC1)NCCCCOc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.426 0.614 0.059 0.4 0.872 0.987 0.35 0.51 0.428 0.154 0.194 Compound_119 COc1ccc(c(c1)Cl)C(=C(c1ccc2c(c1)ncs2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.817 0.669 0.949 0.557 0.753 0.663 0.992 0.81 0.579 0.815 0.791 Compound_120 N#Cc1cc(Cl)ccc1C(=C(c1ccc2c(c1)ncs2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.797 0.573 0.835 0.485 0.741 0.659 0.994 0.593 0.568 0.629 0.752 Compound_121 CCCn1c(cc(c1c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.715 0.511 0.555 0.781 0.976 0.987 0.928 0.977 0.836 0.025 0.443 Compound_122 Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCCC1 0.415 0.539 0.191 0.677 0.88 0.919 0.008 0.503 0.376 0.5 0.048 Compound_123 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccccc1)C)O)C 0.474 0.823 0.448 0.427 0.969 0.817 0.015 0.83 0.201 0.418 0.728 Compound_124 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(O)cccc2C(=C1c1ccc(cc1)F)C 0.505 0.619 0.261 0.512 0.926 0.384 0.561 0.885 0.306 0.112 0.332 Compound_125 COC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.987 0.663 0.258 0.759 0.996 0.996 0.908 0.994 0.511 0.936 0.954 Compound_126 OCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.583 0.653 0.016 0.517 0.911 0.99 0.703 0.547 0.422 0.061 0.184 Compound_127 OCCCCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.98 0.549 0.055 0.765 0.995 0.997 0.983 0.875 0.405 0.979 0.508 Compound_128 CCNc1c(C=NO)ccc(c1c1ccccc1)c1ccccc1 0.505 0.698 0.958 0.66 0.563 0.781 0.967 0.342 0.433 0.92 0.869 Compound_129 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1cscc1C 0.672 0.749 0.692 0.457 0.848 0.699 1.0 0.415 0.599 0.687 0.834 Compound_130 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cc[nH]2 0.589 0.534 0.619 0.503 0.908 0.7 0.929 0.975 0.207 0.905 0.769 Compound_131 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccnc1)C)O 0.534 0.638 0.21 0.458 0.864 0.561 0.079 0.919 0.286 0.332 0.476 Compound_132 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)C 0.654 0.735 0.85 0.6 0.892 0.763 0.992 0.914 0.658 0.852 0.776 Compound_133 Oc1ccc2c(c1)C(c1ccc(cc1)OCCN1CCCCC1)c1c(C2)sc2c1ccc(c2)O 0.643 0.461 0.775 0.627 0.826 0.725 0.642 0.914 0.413 0.747 0.757 Compound_134 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CCC2C1C2 0.461 0.54 0.304 0.561 0.892 0.667 0.009 0.387 0.334 0.981 0.909 Compound_135 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1Cl)F 0.59 0.621 0.877 0.475 0.989 0.77 0.577 0.984 0.329 0.836 0.615 Compound_136 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)F)C)O)C 0.482 0.796 0.764 0.435 0.969 0.786 0.016 0.91 0.254 0.483 0.606 Compound_137 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1 0.499 0.601 0.455 0.512 0.959 0.87 0.062 0.971 0.22 0.779 0.369 Compound_138 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)CC(F)(F)F 0.782 0.632 0.221 0.449 0.991 0.91 0.859 0.868 0.679 0.022 0.537 Compound_139 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)CC)O 0.576 0.593 0.17 0.531 0.961 0.567 0.048 0.892 0.161 0.802 0.608 Compound_140 Oc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)OCCCCNC(=O)C1CC2CC1C=C2 0.505 0.615 0.121 0.465 0.929 0.967 0.226 0.98 0.4 0.177 0.194 Compound_141 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1F)Cl 0.632 0.621 0.877 0.475 0.971 0.746 0.577 0.984 0.338 0.836 0.615 Compound_142 FCCCN1CC(C1)Oc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1 0.61 0.442 0.568 0.511 0.832 0.659 0.841 0.914 0.4 0.959 0.576 Compound_143 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C=C1c1cccc(c1)O)O 0.611 0.57 0.163 0.557 0.966 0.602 0.167 0.86 0.16 0.953 0.63 Compound_144 O=C(OC(C)(C)C)NC(C(=O)NCCCCOc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)Cc1c[nH]c2c1cccc2 0.767 0.759 0.121 0.37 0.873 0.715 0.997 0.641 0.41 0.89 0.77 Compound_145 NCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.691 0.571 0.014 0.436 0.916 0.988 0.512 0.526 0.455 0.015 0.417 Compound_146 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(F)c(cc2C(=C1c1ccc(cc1)F)C)O 0.577 0.619 0.182 0.483 0.967 0.567 0.477 0.944 0.34 0.215 0.368 Compound_147 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2CC3CC1CC(C2)C3 0.518 0.57 0.195 0.551 0.884 0.675 0.061 0.476 0.315 0.922 0.864 Compound_148 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1C2CCCC1CCC2 0.505 0.572 0.141 0.519 0.852 0.683 0.043 0.273 0.299 0.926 0.899 Compound_149 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1C2CCCC1CC2 0.499 0.54 0.141 0.519 0.872 0.675 0.021 0.273 0.245 0.971 0.874 Compound_150 CCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCc2c1cc(O)cc2)c1ccc(cc1)O 0.434 0.666 0.349 0.498 0.928 0.836 0.061 0.937 0.265 0.591 0.687 Compound_151 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)CC1CC1 0.769 0.672 0.104 0.464 0.982 0.909 0.767 0.93 0.69 0.01 0.506 Compound_152 CC1=CCC2(CC1C(OC2(C)C)c1ccc(c(c1)F)O)O 0.863 0.659 0.075 0.567 0.965 0.821 0.522 0.92 0.569 0.931 0.83 Compound_153 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C1CCC1 0.769 0.638 0.089 0.457 0.989 0.691 0.767 0.911 0.525 0.009 0.508 Compound_154 COc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)N1CCOCC1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.863 0.739 0.326 0.399 0.993 0.684 0.777 0.76 0.502 0.811 0.59 Compound_155 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(O)ccc2C2=C1c1cc(O)ccc1OCC2 0.641 0.652 0.269 0.532 0.951 0.629 0.254 0.827 0.246 0.964 0.477 Compound_156 OC(=O)C=Cc1cc(F)c(c(c1)F)C12CC=CC(N1CC(F)(C)C)Cc1c2[nH]c2c1cccc2 0.563 0.654 0.219 0.341 0.921 0.718 0.992 0.431 0.499 0.051 0.169 Compound_157 COc1cc(C=CC(=O)O)ccc1C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.536 0.685 0.597 0.361 0.852 0.706 0.994 0.444 0.567 0.38 0.585 Compound_158 CC(CN1C(C)Cc2c(C1c1ccc(cc1)C=CC(=O)O)ccc1c2cn[nH]1)C 0.464 0.73 0.335 0.274 0.835 0.681 0.992 0.456 0.497 0.082 0.239 Compound_159 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cccc1C 0.614 0.735 0.812 0.623 0.894 0.75 0.992 0.953 0.611 0.852 0.776 Compound_160 OCCCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.541 0.604 0.016 0.534 0.826 0.985 0.721 0.677 0.42 0.138 0.144 Compound_161 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)F 0.672 0.569 0.933 0.544 0.9 0.726 0.992 0.911 0.563 0.94 0.752 Compound_162 Nc1ccc(cc1)C1=C(Cc2c1ccc(c2)O)c1ccc(cc1)O 0.57 0.757 0.911 0.545 0.998 0.984 0.973 0.859 0.657 0.875 0.999 Compound_163 FCC(CN1C(c2c(F)cc(cc2F)C=CC(=O)O)c2ccc(cc2CC1(C)C)O)C 0.474 0.628 0.102 0.424 0.622 0.827 0.185 0.968 0.477 0.416 0.201 Compound_164 COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)CC(=O)C1CC(C1)Oc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.65 0.538 0.612 0.442 0.93 0.658 0.99 0.59 0.404 0.352 0.418 Compound_165 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2CC1CO2 0.497 0.533 0.17 0.467 0.874 0.66 0.008 0.351 0.241 0.975 0.913 Compound_166 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)O 0.518 0.606 0.283 0.534 0.959 0.87 0.062 0.974 0.278 0.694 0.5 Compound_167 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)F)C1CCC1)c1ccc2c(c1)ncs2 0.801 0.597 0.762 0.511 0.751 0.665 0.996 0.553 0.63 0.615 0.612 Compound_168 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1)OC(F)(F)F 0.422 0.574 0.04 0.374 0.981 0.852 0.993 0.931 0.435 0.845 0.537 Compound_169 N#Cc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCC(C1)C)C)ccc(c2)O 0.607 0.793 0.42 0.481 0.974 0.525 0.057 0.899 0.309 0.418 0.867 Compound_170 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1)O 0.519 0.606 0.455 0.512 0.959 0.87 0.062 0.971 0.084 0.694 0.5 Compound_171 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1Cl 0.624 0.665 0.842 0.444 0.936 0.716 1.0 0.281 0.647 0.742 0.88 Compound_172 COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)CCC1CCN(CC1)c1ccc(cc1F)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.782 0.56 0.397 0.464 0.889 0.706 0.994 0.697 0.411 0.39 0.27 Compound_173 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1Cl 0.552 0.621 0.757 0.5 0.986 0.788 0.019 0.957 0.263 0.836 0.615 Compound_174 N#Cc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)c1c[nH]nc1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.802 0.68 0.191 0.454 0.912 0.654 0.991 0.196 0.494 0.128 0.799 Compound_175 CCCCN(C(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)C 0.749 0.73 0.64 0.746 0.926 0.996 0.397 0.99 0.457 0.438 0.397 Compound_176 OCCCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.981 0.589 0.068 0.756 0.994 1.0 0.982 0.87 0.407 0.94 0.542 Compound_177 CCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.603 0.616 0.077 0.57 0.899 0.991 0.494 0.983 0.446 0.226 0.217 Compound_178 CCCCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.577 0.675 0.077 0.572 0.881 0.991 0.494 0.981 0.465 0.258 0.263 Compound_179 OC(=O)C=Cc1cc(F)c(c(c1)F)C12CCCC(N1CC(F)(C)C)Cc1c2[nH]c2c1cccc2 0.516 0.654 0.144 0.352 0.878 0.724 0.993 0.305 0.511 0.044 0.102 Compound_180 CC(CN1C(C)Cc2c(C1c1c(F)cc(cc1F)C=CC(=O)O)ccc1c2cn[nH]1)C 0.461 0.681 0.209 0.326 0.862 0.683 0.998 0.501 0.459 0.134 0.185 Compound_181 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)F)C1CCC1)c1ccc(cc1)c1cncs1 0.789 0.666 0.554 0.455 0.698 0.672 0.994 0.276 0.489 0.242 0.454 Compound_182 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1C 0.583 0.737 0.654 0.447 0.923 0.721 1.0 0.289 0.574 0.581 0.908 Compound_183 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)CC(C)C 0.765 0.666 0.128 0.446 0.976 0.961 0.767 0.929 0.667 0.231 0.242 Compound_184 Oc1ccc(cc1)Oc1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.841 0.652 0.975 0.811 0.925 0.784 0.912 0.99 0.989 0.909 0.843 Compound_185 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2C(C1)CC2 0.471 0.464 0.161 0.559 0.905 0.653 0.014 0.55 0.301 0.976 0.74 Compound_186 Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCC1 0.399 0.579 0.191 0.697 0.938 0.979 0.013 0.364 0.403 0.802 0.109 Compound_187 N#CC1CCN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O 0.557 0.714 0.194 0.499 0.975 0.55 0.109 0.935 0.301 0.886 0.859 Compound_188 N#Cc1ccc(c(c1)Cl)C(=C(c1ccc2c(c1)ncs2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.827 0.573 0.743 0.508 0.755 0.659 0.996 0.662 0.563 0.629 0.752 Compound_189 COc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)c1cncs1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.816 0.64 0.452 0.522 0.726 0.668 0.976 0.467 0.455 0.442 0.682 Compound_190 COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)C1CC2C(C1)CC(C2)Oc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.715 0.573 0.481 0.441 0.833 0.661 0.988 0.361 0.41 0.251 0.265 Compound_191 CCCn1c(cc(c1c1ccc(cc1)O)c1ccc(cc1F)O)c1ccc(cc1)O 0.812 0.524 0.666 0.735 0.982 0.979 0.942 0.979 0.899 0.041 0.489 Compound_192 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C(C)C 0.753 0.691 0.173 0.447 0.976 0.961 0.767 0.854 0.669 0.195 0.372 Compound_193 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1C2CCC1CC2 0.471 0.542 0.141 0.54 0.885 0.672 0.009 0.218 0.189 0.971 0.913 Compound_194 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)Cl 0.551 0.621 0.613 0.507 0.991 0.821 0.019 0.971 0.271 0.836 0.615 Compound_195 Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCC1)C)ccc(c2)O 0.485 0.679 0.507 0.461 0.952 0.566 0.013 0.821 0.125 0.558 0.669 Compound_196 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1Cl)C#N 0.739 0.655 0.671 0.518 0.919 0.674 1.0 0.532 0.617 0.742 0.931 Compound_197 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1C 0.545 0.44 0.742 0.561 0.834 0.652 0.956 0.888 0.37 0.944 0.566 Compound_198 OC(=O)C=Cc1ccc(cc1)C1N(CCc2c1ccc(c2)O)c1ccc(cc1)OC(F)(F)F 0.631 0.592 0.459 0.532 0.99 0.905 0.93 0.864 0.511 0.147 0.737 Compound_199 COc1cc(C=CC(=O)O)ccc1C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.542 0.688 0.799 0.411 0.882 0.699 0.998 0.686 0.547 0.339 0.683 Compound_200 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(Cl)c(cc2C(=C1c1ccc(cc1)F)C)O 0.598 0.609 0.182 0.483 0.921 0.626 0.574 0.944 0.354 0.47 0.465 Compound_201 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CC2CC1CC2)c1ccc(cc1)O 0.467 0.626 0.706 0.755 0.895 0.817 0.94 0.736 0.337 0.45 0.874 Compound_202 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2C(C1)CCCC2 0.505 0.51 0.161 0.539 0.908 0.69 0.037 0.526 0.315 0.976 0.884 Compound_203 CC1=CCC2(CC1C(OC2(C)C)c1ccc(cc1Cl)O)O 0.841 0.699 0.045 0.542 0.99 0.743 0.202 0.863 0.615 0.944 0.932 Compound_204 Oc1ccc2c(c1)sc(c2c1ccc(cc1)F)C(=O)C1CCCCC1 0.773 0.529 0.79 0.741 0.91 0.816 0.981 0.991 0.642 0.99 0.494 Compound_205 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)(C)C 0.838 0.674 0.736 0.59 0.935 0.763 0.987 0.896 0.832 0.99 0.781 Compound_206 CCc1ccccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.805 0.7 0.685 0.61 0.923 0.743 0.986 0.878 0.778 0.955 0.532 Compound_207 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(F)(F)F 0.898 0.657 0.699 0.639 0.938 0.729 0.959 0.945 0.663 0.955 0.848 Compound_208 O=C(C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O)NCCC(F)(F)F 0.583 0.504 0.209 0.675 0.887 0.728 0.972 0.964 0.655 0.278 0.608 Compound_209 CCN1CCC(C1)Oc1ccc(cc1)C1=C(CCc2c1cc(O)cc2)c1ccc(cc1)O 0.431 0.648 0.337 0.497 0.928 0.836 0.061 0.942 0.237 0.551 0.806 Compound_210 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnnn1C)c1ccc(cc1)O 0.923 0.734 0.93 0.735 0.731 0.719 0.246 0.978 0.906 0.943 0.671 Compound_211 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1C)C#N 0.697 0.727 0.463 0.456 0.924 0.675 1.0 0.441 0.641 0.581 0.939 Compound_212 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccccc1Cl 0.481 0.628 0.332 0.376 0.975 0.895 0.461 0.816 0.535 0.612 0.534 Compound_213 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C(F)(F)F)F 0.891 0.647 0.925 0.571 0.935 0.712 0.959 0.95 0.636 0.952 0.79 Compound_214 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc2c(c1)ncs2 0.838 0.605 0.83 0.571 0.764 0.663 0.997 0.76 0.433 0.691 0.708 Compound_215 FCCCN1CC(C1)Oc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cc(cc1C)F 0.58 0.546 0.836 0.594 0.82 0.65 0.966 0.951 0.458 0.832 0.456 Compound_216 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1 0.593 0.422 0.713 0.54 0.839 0.662 0.926 0.851 0.421 0.976 0.644 Compound_217 CCCNC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.624 0.604 0.077 0.565 0.915 0.991 0.494 0.984 0.45 0.188 0.265 Compound_218 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)F)C1CCC1)c1ccc(cc1)c1c[nH]nc1 0.74 0.691 0.338 0.42 0.927 0.658 0.992 0.135 0.536 0.128 0.611 Compound_219 OC(=O)C=Cc1ccc(cc1)C(=C(c1ncc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc2c(c1)ncs2 0.754 0.605 0.683 0.607 0.728 0.661 0.999 0.916 0.578 0.482 0.627 Compound_220 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1C 0.645 0.669 0.753 0.613 0.906 0.737 0.992 0.902 0.482 0.888 0.673 Compound_221 ON=Cc1ccc(c(c1O)c1ccccc1)c1ccccc1 0.665 0.707 0.633 0.742 0.843 0.956 0.679 0.767 0.601 0.925 0.931 Compound_222 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccccc2C(=C1c1ccccc1)C 0.442 0.569 0.137 0.457 0.881 0.573 0.011 0.882 0.24 0.536 0.425 Compound_223 CC1=CCC2(CC1C(OC2(C)C)c1ccc(cc1F)O)O 0.896 0.659 0.045 0.542 0.965 0.821 0.522 0.863 0.647 0.931 0.83 Compound_224 N#Cc1cc(Cl)ccc1C(=C(c1ccc(cc1)c1c[nH]nc1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.769 0.68 0.512 0.385 0.898 0.654 0.976 0.133 0.497 0.128 0.799 Compound_225 COCC(CN1C(C)Cc2c(C1c1c(F)cc(cc1F)C=CC(=O)O)ccc(c2)O)C 0.439 0.679 0.058 0.407 0.754 0.808 0.715 0.787 0.475 0.456 0.573 Compound_226 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CCC2(CC1)CCCC2 0.49 0.59 0.178 0.489 0.893 0.707 0.055 0.491 0.242 0.874 0.924 Compound_227 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1)F 0.644 0.408 0.821 0.574 0.846 0.661 0.971 0.893 0.42 0.979 0.595 Compound_228 COc1c(F)c(C=CC(=O)O)ccc1C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.562 0.668 0.833 0.37 0.872 0.697 0.997 0.526 0.52 0.341 0.599 Compound_229 Oc1ccc(cc1)C1Sc2cc(O)ccc2OC1c1ccc(cc1)OCCN1CC2CCC1CC2 0.499 0.572 0.143 0.541 0.859 0.677 0.034 0.376 0.288 0.922 0.892 Compound_230 CN(CCOc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)O)C 0.475 0.349 0.019 0.794 0.964 0.986 0.004 0.15 0.353 0.02 0.081 Compound_231 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)N)CCC 0.925 0.692 0.911 0.559 0.926 0.997 0.949 0.978 0.678 0.881 0.994 Compound_232 FCC(CN1C(c2ccc(cc2)C=CC(=O)O)c2ccc(cc2CC1(C)C)O)C 0.533 0.687 0.221 0.393 0.5 0.86 0.033 0.965 0.554 0.433 0.292 Compound_233 CC(CN1C(C)Cc2c(C1c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.45 0.657 0.301 0.356 0.58 0.869 0.026 0.811 0.504 0.207 0.076 Compound_234 O=C(C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)NCC(F)(F)F 0.803 0.464 0.06 0.525 0.968 0.976 0.897 0.994 0.483 0.155 0.882 Compound_235 N#CC=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.977 0.693 0.115 0.744 0.989 0.962 0.96 0.988 0.541 0.992 0.997 Compound_236 CCCCc1ccc(cc1)N1CCc2c(C1(C)c1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.769 0.719 0.154 0.44 0.975 0.957 0.712 0.885 0.804 0.017 0.633 Compound_237 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)S(=O)(=O)C)C)O)C 0.487 0.832 0.496 0.421 0.777 0.836 0.015 0.777 0.333 0.923 0.331 Compound_238 OC(=O)C=Cc1ccc(cc1)C(=C(c1ncc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc(cc1)c1cncs1 0.78 0.644 0.213 0.572 0.695 0.67 0.997 0.878 0.485 0.128 0.516 Compound_239 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cc(cc1C)F 0.565 0.516 0.919 0.565 0.826 0.652 0.988 0.947 0.472 0.889 0.517 Compound_240 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)C 0.569 0.52 0.852 0.584 0.822 0.661 0.96 0.9 0.495 0.879 0.573 Compound_241 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc2n(c1)ccn2 0.689 0.546 0.199 0.481 0.87 0.67 0.989 0.704 0.351 0.553 0.581 Compound_242 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cn[nH]2 0.605 0.615 0.748 0.52 0.92 0.701 0.954 0.937 0.342 0.299 0.605 Compound_243 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)F)C1CCC1)c1ccc2n(c1)ccn2 0.657 0.551 0.228 0.387 0.869 0.674 0.971 0.304 0.406 0.471 0.439 Compound_244 COc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)c1c[nH]nc1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.764 0.658 0.276 0.527 0.91 0.657 0.989 0.266 0.501 0.381 0.764 Compound_245 N#Cc1ccc(cc1)C1=C(C)c2c(OC1c1ccc(cc1)OCC(N1CCC(C1)C)C)ccc(c2)O 0.552 0.793 0.401 0.53 0.977 0.586 0.163 0.929 0.318 0.418 0.867 Compound_246 CC(CN1C(c2ccc(cc2)C=CC(=O)O)c2ccc3c(c2CC1(C)C)cn[nH]3)C 0.479 0.723 0.243 0.253 0.812 0.683 0.992 0.626 0.498 0.229 0.351 Compound_247 CCCc1c(cn(c1c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.225 0.626 0.223 0.709 0.896 0.951 0.916 0.907 0.836 0.129 0.789 Compound_248 CC(CN1C(c2c(F)cc(cc2F)C=CC(=O)O)c2ccc(cc2CC1(C)C)O)C 0.432 0.66 0.102 0.377 0.622 0.827 0.185 0.919 0.467 0.333 0.169 Compound_249 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)F)C1CCC1)c1ccc(cc1)N1CCOCC1 0.856 0.639 0.541 0.386 0.997 0.677 0.943 0.825 0.547 0.49 0.446 Compound_250 CC1=CCC2(CC1C(OC2(C)C)c1ccc(cc1)O)O 0.861 0.667 0.07 0.536 0.965 0.875 0.522 0.857 0.427 0.932 0.834 Compound_251 OC(=O)C=Cc1ccc(cc1)C1N(c2ccc(cc2)OC(F)(F)F)C(C)Cc2c1ccc(c2)O 0.646 0.571 0.463 0.536 0.987 0.888 0.863 0.826 0.465 0.246 0.692 Compound_252 Oc1ccc2c(c1)CC(=C2c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.398 0.693 0.24 0.678 0.937 0.668 0.046 0.697 0.245 0.617 0.349 Compound_253 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccccc1)C1CCC1)c1ccc(cc1)c1cncs1 0.752 0.712 0.093 0.412 0.585 0.68 0.986 0.1 0.444 0.12 0.425 Compound_254 CCCCCC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.987 0.71 0.286 0.752 0.987 0.997 0.776 0.988 0.462 1.0 0.977 Compound_255 O=C(c1cccc(c1)C(F)(F)F)Nc1ccc2c(c1)[nH]cc2 0.632 0.754 1.0 0.713 0.715 0.694 0.826 0.992 0.643 0.87 0.965 Compound_256 CCCCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.903 0.59 0.025 0.585 0.859 0.77 0.93 0.888 0.563 0.583 0.478 Compound_257 CCCCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.981 0.642 0.233 0.822 0.997 1.0 0.854 0.994 0.511 0.974 0.87 Compound_258 N#Cc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)c1cncs1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.828 0.665 0.266 0.484 0.736 0.661 0.993 0.345 0.464 0.253 0.668 Compound_259 N#Cc1cc(Cl)ccc1C(=C(c1ccc(cc1)c1cncs1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.797 0.665 0.663 0.432 0.705 0.66 0.99 0.261 0.466 0.253 0.668 Compound_260 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc(cc1)N1CCOCC1 0.888 0.619 0.418 0.42 0.997 0.669 0.99 0.78 0.412 0.572 0.565 Compound_261 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)OCCN1CCC1)C(=O)c1ccccc1C 0.518 0.462 0.483 0.588 0.828 0.651 0.901 0.819 0.369 0.915 0.49 Compound_262 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C12CCCC(N1CC(F)(C)C)Cc1c2[nH]c2c1cccc2 0.574 0.578 0.361 0.457 0.86 0.673 0.933 0.749 0.54 0.24 0.438 Compound_263 Oc1ccc2c(c1)CCC1C2CCC2(C1CC(C2O)O)C 0.952 0.924 0.01 0.409 0.99 0.947 0.13 0.213 0.056 0.988 0.731 Compound_264 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)OC(F)(F)F 0.499 0.624 0.322 0.527 0.99 0.71 0.81 0.957 0.151 0.426 0.511 Compound_265 Oc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)OCCCCNC(=O)C12CC3CC2CC(C1)C3 0.441 0.74 0.061 0.423 0.925 0.968 0.226 0.684 0.407 0.045 0.314 Compound_266 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1cccc(c1)Cl 0.628 0.678 0.836 0.411 0.925 0.713 1.0 0.265 0.496 0.648 0.876 Compound_267 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccncc1Cl 0.505 0.657 0.788 0.431 0.868 0.693 0.998 0.411 0.663 0.253 0.791 Compound_268 Oc1ccc2c(c1)C(=C(CC2)c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCC1 0.488 0.699 0.24 0.691 0.947 0.93 0.062 0.67 0.395 0.793 0.651 Compound_269 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1ccc(cc1)C 0.708 0.695 0.506 0.715 0.947 0.954 0.736 0.788 0.431 0.717 0.28 Compound_270 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)SC(F)(F)F 0.474 0.596 0.322 0.527 0.97 0.684 0.783 0.957 0.169 0.726 0.666 Compound_271 O=C(C1CCC(CC1)C(F)(F)F)NCCCCOc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.483 0.532 0.051 0.426 0.94 0.98 0.823 0.76 0.412 0.1 0.397 Compound_272 COc1cc(C=Cc2ccc(cc2)OS(=O)(=O)C2CC3OC2C(=C3c2ccc(cc2)O)c2ccc(cc2)O)cc(c1)OC 0.662 0.715 0.384 0.729 0.949 0.916 0.712 0.572 0.424 0.758 0.295 Compound_273 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccccc1)C1CCC1)c1ccc(cc1)c1c[nH]nc1 0.704 0.728 0.084 0.393 0.919 0.66 0.993 0.048 0.497 0.059 0.656 Compound_274 Oc1ccc2c(c1)CC(=C2c1ccc(cc1)C(F)(F)F)c1ccc(cc1)O 0.743 0.617 0.784 0.691 0.998 0.915 0.988 0.98 0.373 0.993 0.998 Compound_275 FCCCN1CC(C1)Oc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1C 0.562 0.46 0.511 0.533 0.827 0.649 0.864 0.945 0.36 0.905 0.5 Compound_276 OC(=O)C=Cc1ccc(cc1)C1c2ccc(cc2CC(N1CC(F)(C)C)(C)C)O 0.517 0.68 0.3 0.398 0.488 0.852 0.025 0.936 0.589 0.347 0.241 Compound_277 ON=Cc1ccc(c(c1N)c1ccccc1)c1ccccc1 0.721 0.804 0.97 0.769 0.758 0.904 0.995 0.669 0.577 0.863 0.939 Compound_278 N#Cc1ccc(cc1)C(=O)Nc1ccc2c(c1)[nH]cc2 0.59 0.811 0.987 0.722 0.707 0.672 0.948 0.941 0.912 0.98 0.983 Compound_279 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCNCCCCCCCC)CCC 0.274 0.577 0.073 0.461 0.468 0.949 0.309 0.172 0.511 0.115 0.407 Compound_280 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)F)C)N 0.513 0.587 0.574 0.435 0.952 0.704 0.801 0.858 0.391 0.25 0.477 Compound_281 COc1ccc(cc1)c1c(oc(c1CC)c1ccc(cc1)O)c1ccc(cc1)O 0.238 0.709 0.978 0.859 0.924 0.979 0.993 0.944 0.918 0.461 0.886 Compound_282 COc1cc(C=CC(=O)O)ccc1C1(C)N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.527 0.698 0.356 0.394 0.83 0.708 0.994 0.212 0.579 0.38 0.622 Compound_283 Cc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.899 0.775 0.919 0.866 0.92 0.843 0.963 0.988 0.578 0.878 0.4 Compound_284 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.598 0.777 0.525 0.415 0.927 0.731 1.0 0.361 0.67 0.591 0.894 Compound_285 CCOc1ccc2c(c1)CCCC(=C2c1ccc(cc1)O)c1ccccc1 0.701 0.698 0.58 0.66 0.995 0.96 0.708 0.963 0.511 0.904 0.967 Compound_286 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)F 0.588 0.426 0.92 0.565 0.841 0.651 0.987 0.889 0.448 0.949 0.52 Compound_287 OC(=O)C=Cc1ccc(cc1)C(=C(c1ncc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc(cc1)c1c[nH]nc1 0.68 0.651 0.305 0.54 0.903 0.657 0.987 0.675 0.505 0.028 0.638 Compound_288 CNCCOc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1 0.505 0.642 0.082 0.292 0.952 0.745 0.122 0.265 0.363 0.043 0.175 Compound_289 CCOc1ccc2c(c1)CCCC(=C2c1ccc(cc1)OCCN(C)C)c1ccccc1 0.435 0.564 0.008 0.758 0.91 0.906 0.01 0.735 0.19 0.033 0.332 Compound_290 Oc1ccc(cc1)c1nn(c2c1cccc2C(F)(F)F)C(C)C 0.677 0.692 0.935 0.813 0.895 0.725 0.801 0.994 0.698 0.662 0.881 Compound_291 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1C#N 0.714 0.728 0.689 0.438 0.924 0.675 1.0 0.361 0.639 0.606 0.94 Compound_292 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1cccc(c1Cl)F 0.474 0.628 0.608 0.356 0.98 0.877 0.953 0.954 0.495 0.612 0.534 Compound_293 Oc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)OCCCNC(=O)C12CC3CC(C2)CC(C1)C3 0.357 0.712 0.013 0.399 0.896 0.989 0.527 0.637 0.388 0.026 0.441 Compound_294 CCC(=C(c1ccc2c(c1)cc[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.553 0.73 0.422 0.391 0.867 0.751 0.998 0.344 0.782 0.386 0.948 Compound_295 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnn(n1)C)c1ccc(cc1)O 0.889 0.75 0.965 0.769 0.761 0.721 0.671 0.944 0.945 0.909 0.649 Compound_296 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)F)C)F 0.418 0.581 0.446 0.445 0.906 0.557 0.384 0.924 0.487 0.52 0.366 Compound_297 FCC1CCN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1c(C)cc(cc1C)F 0.6 0.587 0.948 0.588 0.868 0.711 0.989 0.924 0.451 0.889 0.729 Compound_298 CCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O 0.983 0.602 0.47 0.81 0.998 0.997 0.881 0.994 0.46 0.974 0.958 Compound_299 Fc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]cc2 0.355 0.346 0.68 0.513 0.642 0.683 0.253 0.91 0.264 0.714 0.608 Compound_300 FCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.296 0.447 0.014 0.417 0.928 0.972 0.048 0.095 0.452 0.6 0.236 Compound_301 N#CC(c1cc(CSc2ccc(cc2)OS(=O)(=O)N)cc(c1)Cn1ncnc1)(C)C 0.399 0.463 0.472 0.613 0.426 0.673 0.224 0.057 0.404 0.001 0.599 Compound_302 CCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.274 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_303 ON=Cc1ccc(c(c1NC)c1ccccc1)c1ccc(cc1)O 0.661 0.742 0.98 0.724 0.944 0.966 0.72 0.782 0.594 0.97 0.902 Compound_304 ON=Cc1ccc(c(c1NC)c1ccccc1)c1ccccc1 0.74 0.79 0.983 0.749 0.655 0.789 0.976 0.776 0.545 0.94 0.918 Compound_305 CCCc1ccc(cc1)C(=O)N(c1ccc(cc1)O)c1ccc(cc1)O 0.885 0.606 0.364 0.592 0.986 0.995 0.82 0.6 0.849 0.282 0.266 Compound_306 CCc1c(oc(c1c1ccc(cc1)OCCN1CCCCC1)c1ccccc1)c1ccc(cc1)O 0.084 0.492 0.735 0.741 0.64 0.894 0.933 0.846 0.612 0.053 0.276 Compound_307 Oc1ccc(cc1)N(c1ccc(cc1)O)Cc1cccc(c1C)C 0.672 0.684 0.909 0.679 0.984 0.967 0.097 0.196 0.839 0.213 0.788 Compound_308 Oc1ccc(cc1)c1c(oc2c(c1=O)ccc(c2)O)C(=O)c1ccc(cc1)OCCN1CCCCC1 0.836 0.731 0.575 0.659 0.922 0.899 0.692 0.927 0.342 0.602 0.656 Compound_309 Oc1ccc(cc1)C1=C(c2ccc(cc2)F)c2c(C1)cc(cc2)O 0.684 0.655 0.571 0.619 0.994 0.856 0.981 0.891 0.761 0.988 0.989 Compound_310 CC(CN1CCc2c(C1c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.442 0.637 0.286 0.377 0.58 0.869 0.026 0.86 0.521 0.037 0.047 Compound_311 Oc1ccc(cc1)C1Oc2ccc(cc2C(=O)C1C)O 0.594 0.807 0.581 0.622 0.956 0.928 0.827 0.486 0.24 0.418 0.693 Compound_312 COc1ccc2c(c1)CCCC(=C2c1ccc(cc1)O)c1ccccc1 0.72 0.767 0.544 0.661 0.989 0.95 0.715 0.746 0.821 0.914 0.936 Compound_313 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C 0.872 0.735 0.824 0.634 0.923 0.743 0.986 0.904 0.677 0.912 0.451 Compound_314 CCC(=C(c1ccc(cc1OC)C=CC(=O)O)c1ccc2c(c1)cn[nH]2)c1ccccc1 0.552 0.783 0.702 0.501 0.926 0.744 1.0 0.388 0.686 0.758 0.966 Compound_315 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1OC 0.521 0.783 0.776 0.512 0.923 0.751 1.0 0.389 0.644 0.758 0.966 Compound_316 Oc1ccc2c(c1)c(Cl)c(n2Cc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)O 0.705 0.618 0.749 0.744 0.987 0.927 0.901 0.684 0.369 0.861 0.965 Compound_317 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C)F 0.88 0.631 0.957 0.549 0.918 0.731 0.986 0.913 0.722 0.924 0.514 Compound_318 OC(=O)C=Cc1ccc(cc1)C1=C(CCSc2c1ccc(c2)F)c1ccc(cc1)O 0.583 0.522 0.322 0.496 0.975 0.92 0.958 0.934 0.669 0.936 0.83 Compound_319 OC(=O)C=Cc1ccc(cc1)C(=C(c1ncc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc(cc1)N1CCOCC1 0.779 0.682 0.471 0.435 0.975 0.659 0.998 0.913 0.511 0.571 0.575 Compound_320 Oc1ccc2c(c1)CC(=C2c1ccc(cc1)C(=O)N)c1ccc(cc1)O 0.649 0.802 0.081 0.292 0.966 0.992 0.853 0.018 0.511 0.293 0.86 Compound_321 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(F)F 0.873 0.644 0.87 0.663 0.944 0.738 0.958 0.927 0.682 0.919 0.753 Compound_322 N#Cc1ccc(c(c1)Cl)C(=C(c1ccc(cc1)N1CCOCC1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.859 0.679 0.329 0.434 0.994 0.651 0.957 0.771 0.503 0.42 0.746 Compound_323 N#Cc1cc(Cl)ccc1C(=C(c1ccc2n(c1)ccn2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.67 0.52 0.379 0.365 0.71 0.66 0.947 0.241 0.408 0.471 0.648 Compound_324 Oc1ccc(cc1)C1=C(c2ccccc2)c2c(C1)cc(cc2)O 0.599 0.703 0.83 0.574 0.997 0.937 0.879 0.88 0.58 0.976 0.996 Compound_325 OC(=O)C=Cc1ccc(cc1)C1N(CCc2c1ccc(c2)O)c1ccccc1 0.617 0.649 0.673 0.468 0.98 0.931 0.366 0.949 0.408 0.052 0.253 Compound_326 Brc1ccc(cc1)C(=O)Nc1ccc2c(c1)[nH]cc2 0.603 0.782 0.997 0.789 0.494 0.655 0.287 0.953 0.603 0.991 0.866 Compound_327 CCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.274 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_328 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccc(cc1Cl)C(F)(F)F)C1CCC1)c1ccc(cc1)c1c[nH]nc1 0.808 0.681 0.282 0.522 0.926 0.657 0.995 0.467 0.419 0.236 0.694 Compound_329 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCNCCCCCCCCCC)CCC 0.288 0.577 0.073 0.461 0.56 0.956 0.309 0.172 0.511 0.115 0.407 Compound_330 Oc1ccc2c(c1)CCC1C2CCC2(C1C(O)C(C2O)O)C 0.948 0.781 0.012 0.404 0.968 0.739 0.048 0.201 0.071 0.955 0.768 Compound_331 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCNCCCCCCCCCCCC)CCC 0.288 0.577 0.073 0.461 0.56 0.956 0.309 0.172 0.511 0.115 0.407 Compound_332 CC(=O)OC1CCC2C1(C)CCC1C2C(Sc2ccc(cc2)Br)C(=O)c2c1ccc(c2)O 0.825 0.766 0.1 0.534 0.794 0.829 0.583 0.648 0.316 0.978 0.976 Compound_333 N#Cc1cc(Cl)ccc1C(=C(c1ccc(cc1)N1CCOCC1)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.821 0.679 0.767 0.403 0.991 0.651 0.97 0.781 0.511 0.42 0.746 Compound_334 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)O 0.577 0.413 0.821 0.556 0.838 0.651 0.928 0.929 0.416 0.971 0.635 Compound_335 Oc1ccc2c(c1)sc(c2c1ccc(cc1)F)C(=O)c1ccc(cc1)C(F)(F)F 0.731 0.637 0.929 0.764 0.94 0.794 0.987 0.996 0.533 0.966 0.686 Compound_336 FCCCN1CC(C1)Oc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1C)F 0.604 0.446 0.843 0.542 0.835 0.649 0.962 0.918 0.435 0.92 0.457 Compound_337 C#Cc1ccc(cc1)C(=O)c1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.737 0.647 0.908 0.72 0.868 0.748 0.985 0.983 0.725 0.941 0.576 Compound_338 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(c(c1)F)O 0.544 0.666 0.655 0.788 0.974 0.935 0.943 0.643 0.34 0.554 0.833 Compound_339 CCCCCc1ccc(cc1)N1CCc2c(C1(C)c1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.79 0.729 0.154 0.45 0.974 0.978 0.867 0.902 0.796 0.02 0.668 Compound_340 CC(CN1C(C)Cc2c(C1(C)c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.469 0.663 0.3 0.384 0.425 0.88 0.026 0.69 0.535 0.278 0.241 Compound_341 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc3cn[nH]c3cc2C(=C1c1ccc(cc1)F)C 0.535 0.661 0.69 0.436 0.896 0.672 0.963 0.882 0.423 0.149 0.376 Compound_342 CC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)S(=O)(=O)C)C)O)C 0.483 0.832 0.477 0.47 0.881 0.722 0.015 0.836 0.381 0.923 0.331 Compound_343 COCC(CN1C(C)Cc2c(C1c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.45 0.71 0.196 0.4 0.597 0.871 0.202 0.767 0.523 0.407 0.664 Compound_344 CCC(=C(c1ccc(cc1)OCCCC(=O)NCc1ccc(c(c1)C(=O)O)c1c2ccc(=O)cc2oc2c1ccc(c2)O)CC)c1ccc(cc1)O 0.776 0.812 0.143 0.619 0.854 0.98 0.8 0.934 0.534 0.467 0.24 Compound_345 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)OC1CN(C1)C1CC1)C(=O)c1c(C)cc(cc1C)F 0.551 0.602 0.834 0.506 0.812 0.648 0.808 0.88 0.45 0.71 0.488 Compound_346 OC(=O)C=Cc1ccc(cc1)C(=C(c1ccccc1)C1CCC1)c1ccc2c(c1)ncs2 0.771 0.67 0.492 0.47 0.712 0.67 0.991 0.539 0.588 0.477 0.51 Compound_347 CCC(=C(c1cccc2c1cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.587 0.777 0.525 0.415 0.913 0.708 0.999 0.24 0.634 0.591 0.894 Compound_348 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(c(c1)C)C=CC(=O)O)c1ccccc1 0.654 0.741 0.622 0.424 0.923 0.721 1.0 0.356 0.683 0.581 0.9 Compound_349 Oc1ccc(cc1)N(C(=O)c1ccc(c(c1)F)O)c1ccc(cc1)O 0.938 0.664 0.528 0.606 0.986 0.991 0.912 0.889 0.45 0.92 0.795 Compound_350 Oc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)F 0.957 0.652 0.972 0.824 0.904 0.747 0.901 0.985 0.989 0.909 0.843 Compound_351 CC(CN1CCc2c(C1c1ccc(cc1)C=CC(=O)O)ccc1c2cn[nH]1)C 0.421 0.666 0.186 0.265 0.835 0.681 0.992 0.573 0.511 0.007 0.175 Compound_352 Oc1ccc(cc1)CC(c1ccc(cc1)O)C 0.539 0.744 0.494 0.546 0.92 0.947 0.963 0.53 0.201 0.798 0.523 Compound_353 CCOC(=O)C1(C#N)Cc2c(C1)cc(cc2)C1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.837 0.836 0.033 0.514 0.997 0.902 0.58 0.573 0.444 0.224 0.928 Compound_354 CCC(=C(c1ccc(cc1)O)c1ccccc1)c1ccccc1 0.774 0.745 0.331 0.596 0.988 0.997 0.261 0.884 0.842 0.962 0.958 Compound_355 Oc1ccc(cc1)C1=C(Cc2c1ccc(c2)O)c1ccc(cc1)O 0.622 0.719 0.667 0.572 0.997 0.937 0.879 0.927 0.554 0.962 0.992 Compound_356 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2=O)C 0.952 0.907 0.068 0.373 0.984 0.996 0.006 0.065 0.045 0.998 0.934 Compound_357 CCCN(S(=O)(=O)c1ccc(c(c1)C)O)c1c(C)cccc1CC 0.35 0.549 0.63 0.588 0.26 0.73 0.337 0.557 0.218 0.373 0.239 Compound_358 CC(CN1C(c2ccc(cc2)C=CC(=O)O)c2ccc(cc2CC1(C)C)O)C 0.458 0.682 0.238 0.355 0.425 0.88 0.026 0.905 0.517 0.287 0.173 Compound_359 CC(CCCCCOC(=O)C=Cc1ccc(cc1)C(=C1C2CC3CC1CC(C2)C3)c1ccc(cc1)O)C 0.981 0.642 0.794 0.804 0.998 1.0 0.854 0.99 0.426 0.984 0.684 Compound_360 Oc1ccc(cc1)N(C(=O)c1cccc(c1C)C)c1ccc(cc1)O 0.857 0.767 0.813 0.564 0.979 0.989 0.939 0.236 0.881 0.322 0.341 Compound_361 Oc1ccc2c(c1)CC(=C2c1ccc(cc1)C(=O)C)c1ccc(cc1)O 0.77 0.696 0.624 0.556 0.992 0.99 0.812 0.888 0.416 0.979 0.96 Compound_362 CCC(=C(c1ccc(cc1)c1cncs1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.681 0.736 0.165 0.4 0.41 0.919 0.997 0.144 0.557 0.142 0.569 Compound_363 COCC(CN1C(c2c(F)cc(cc2F)C=CC(=O)O)c2ccc(cc2CC1(C)C)O)C 0.441 0.71 0.059 0.404 0.636 0.84 0.715 0.894 0.473 0.558 0.598 Compound_364 COc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]cc2 0.308 0.367 0.862 0.414 0.587 0.662 0.167 0.282 0.155 0.247 0.463 Compound_365 CC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCC1 0.303 0.689 0.069 0.553 0.916 0.816 0.059 0.364 0.5 0.785 0.095 Compound_366 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1)Cl 0.421 0.628 0.133 0.359 0.962 0.899 0.392 0.905 0.485 0.612 0.534 Compound_367 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccncc1C 0.441 0.729 0.665 0.444 0.839 0.707 0.996 0.377 0.616 0.101 0.846 Compound_368 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1)SC(F)(F)F 0.401 0.603 0.04 0.374 0.96 0.779 0.983 0.931 0.427 0.45 0.642 Compound_369 FCC1CN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccc(cc1)O 0.604 0.395 0.747 0.563 0.847 0.664 0.926 0.89 0.511 0.988 0.702 Compound_370 O=C(c1ccc(cc1)C(F)(F)F)Nc1ccc2c(c1)[nH]cc2 0.541 0.754 0.995 0.738 0.738 0.706 0.784 0.996 0.573 0.87 0.965 Compound_371 Oc1cccc(c1)c1n(Cc2ccc(cc2)OCCN2CCCCCC2)c2c(c1C)cc(cc2)O 0.473 0.631 0.682 0.84 0.973 0.926 0.956 0.618 0.331 0.59 0.889 Compound_372 CCc1ccc2c(c1)C(Cc1c2c(C)cc(c1)O)c1ccc(cc1)OCCN1CCOCC1 0.448 0.528 0.604 0.671 0.949 0.946 0.132 0.974 0.317 0.127 0.376 Compound_373 Oc1ccc(cc1)C(=C(c1ccccc1)CC(F)(F)F)c1ccc(cc1)O 0.835 0.723 0.301 0.755 1.0 0.995 0.949 0.89 0.711 0.915 0.991 Compound_374 Oc1ccc(cc1)N(C(=O)c1ccc2c(c1)cccc2)c1ccc(cc1)O 0.948 0.79 0.898 0.631 0.989 0.989 0.927 0.967 0.855 0.893 0.844 Compound_375 CSCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.47 0.408 0.01 0.824 0.969 0.991 0.017 0.4 0.319 0.024 0.188 Compound_376 Oc1ccc2c(c1)c1ccc3c(c1cc2)CC(C13CC1C)O 0.271 0.928 0.097 0.554 0.996 0.982 0.077 0.345 0.425 0.998 0.98 Compound_377 Oc1ccc(c(c1)Cl)c1ccc2c(c1)ccc(c2)O 0.948 0.761 0.949 0.718 0.995 0.915 0.927 0.984 0.768 0.98 0.992 Compound_378 Nc1ccc(cc1)C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.866 0.922 0.048 0.421 0.997 0.991 0.869 0.185 0.17 0.244 0.957 Compound_379 C#CCN1C=NC(C1c1ccc(cc1Cl)O)c1ccc(cc1Cl)O 0.362 0.578 0.596 0.555 0.649 0.745 0.02 0.137 0.312 0.58 0.792 Compound_380 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1)Cl 0.615 0.678 0.756 0.402 0.925 0.702 1.0 0.401 0.586 0.648 0.876 Compound_381 Oc1cc(F)c(c(c1)F)c1ccc2c(c1)ccc(c2)O 0.966 0.649 0.949 0.736 0.987 0.968 0.987 0.984 0.629 0.976 0.931 Compound_382 FCC1CCN(C1)CCOc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)C(=O)c1ccccc1C 0.582 0.507 0.708 0.558 0.876 0.715 0.957 0.888 0.367 0.944 0.805 Compound_383 CCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.903 0.59 0.025 0.585 0.859 0.77 0.93 0.888 0.563 0.583 0.478 Compound_384 CC(CN1CCc2c(C1(C)c1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.467 0.698 0.392 0.427 0.442 0.883 0.035 0.862 0.553 0.194 0.192 Compound_385 CCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.274 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_386 N#Cc1c(c2ccc(cc2)O)n(c2c1cc(O)cc2)Cc1ccc(cc1)OCCN1CCCCC1 0.642 0.577 0.816 0.875 0.97 0.854 0.879 0.663 0.388 0.679 0.966 Compound_387 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(c(c1)OC)C=CC(=O)O)c1ccccc1 0.593 0.783 0.65 0.491 0.926 0.744 1.0 0.346 0.674 0.758 0.966 Compound_388 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1c[nH]cn1)c1ccc(cc1)O 0.78 0.803 0.954 0.68 0.732 0.673 0.692 0.909 0.839 0.403 0.957 Compound_389 O=C(Nc1ccccc1)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.615 0.723 0.908 0.717 0.983 0.986 0.941 0.957 0.665 0.81 0.868 Compound_390 CCC(=C(c1ccc(cc1)c1c[nH]nc1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.618 0.738 0.151 0.381 0.877 0.743 0.998 0.069 0.66 0.229 0.802 Compound_391 CCc1c(c(=O)oc2c1ccc(c2)O)c1ccc(cc1F)O 0.505 0.554 0.878 0.593 0.938 0.932 0.993 0.943 0.874 0.737 0.694 Compound_392 CC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCCC1 0.323 0.64 0.069 0.553 0.843 0.755 0.033 0.492 0.458 0.335 0.038 Compound_393 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCCC1)c1ccc(c(c1)F)O 0.57 0.66 0.655 0.788 0.978 0.911 0.964 0.643 0.396 0.774 0.887 Compound_394 Oc1ccc(cc1)CN(c1ccc(cc1)F)c1ccc(cc1)O 0.89 0.609 0.861 0.722 0.992 0.981 0.045 0.575 0.838 0.357 0.913 Compound_395 Oc1ccc2c(c1)c(Cl)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1C)O 0.652 0.649 0.822 0.715 0.976 0.915 0.94 0.931 0.337 0.706 0.898 Compound_396 CCCC[N+](CCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccccc1)(C)C 0.186 0.43 0.063 0.733 0.78 0.99 0.006 0.568 0.613 0.047 0.246 Compound_397 CCC(=C(c1ccccc1)c1ccc(cc1)OCC[N+](CC)(C)C)c1ccccc1 0.233 0.447 0.058 0.672 0.841 0.99 0.006 0.422 0.317 0.007 0.178 Compound_398 Fc1ccc(cc1)c1c(sc2c1ccc(c2)O)C(=O)C1CC1 0.713 0.635 0.79 0.728 0.855 0.744 0.992 0.991 0.579 0.939 0.495 Compound_399 CCCN(S(=O)(=O)c1ccc(c(c1)C)O)c1c(C)cccc1C 0.352 0.559 0.477 0.592 0.232 0.705 0.332 0.292 0.299 0.133 0.226 Compound_400 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)N1CCNCC1)c1ccc(cc1)O 0.497 0.584 0.22 0.469 0.812 0.934 0.526 0.637 0.54 0.014 0.236 Compound_401 CCC(=C(c1ccc2c(c1)nn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.565 0.757 0.3 0.356 0.918 0.7 0.999 0.316 0.783 0.56 0.825 Compound_402 Oc1ccc2c(c1)CC(=C2Cc1ccccc1)c1ccc(cc1)O 0.611 0.642 0.814 0.58 0.997 0.937 0.879 0.925 0.593 0.978 0.994 Compound_403 CCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.274 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_404 OC(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.664 0.552 0.322 0.496 0.986 0.988 0.955 0.934 0.864 0.959 0.866 Compound_405 CCOC(=O)C1(Cc2c(C1)cc(cc2)C1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O)C(=O)OCC 0.859 0.845 0.032 0.518 0.997 0.954 0.552 0.179 0.344 0.957 0.983 Compound_406 Oc1ccc(cc1)N(C(=O)c1ccc(cc1C(F)(F)F)F)c1ccc(cc1)OCCN1CCCCC1 0.559 0.555 0.597 0.548 0.989 0.776 0.992 0.793 0.373 0.394 0.288 Compound_407 CCN1C=NC(C1c1ccc(cc1Cl)O)c1ccc(cc1Cl)O 0.247 0.573 0.805 0.654 0.683 0.756 0.001 0.198 0.256 0.47 0.726 Compound_408 Oc1ccc(c(c1)O)c1nn(c2c1ccc(c2)O)c1cc(Cl)ccc1Cl 0.816 0.728 0.952 0.689 0.949 0.713 0.847 0.944 0.769 0.522 0.964 Compound_409 NCCOc1ccc(cc1)C(=C(c1ccc(cc1)O)CC)c1ccc(cc1)O 0.373 0.543 0.133 0.595 0.955 0.989 0.04 0.144 0.255 0.011 0.24 Compound_410 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccc(cc1)F)C)OC 0.469 0.684 0.266 0.445 0.94 0.539 0.312 0.842 0.355 0.027 0.403 Compound_411 CN(CCOc1ccc2c(c1)CCCC(=C2c1ccc(cc1)O)c1ccccc1)C 0.519 0.532 0.019 0.794 0.967 0.865 0.013 0.752 0.385 0.026 0.152 Compound_412 CCC(=C(c1ccc(cc1)c1cnn(c1)C)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.623 0.705 0.011 0.341 0.774 0.666 0.995 0.115 0.806 0.691 0.711 Compound_413 Oc1ccc(cc1)N(C(=O)c1ccc(c(c1)F)O)c1ccccc1 0.948 0.67 0.522 0.609 0.987 0.992 0.895 0.863 0.321 0.841 0.81 Compound_414 CCC(=C(c1ccc(cc1C)C=CC(=O)O)c1ccc2c(c1)cn[nH]2)c1ccccc1 0.628 0.741 0.6 0.424 0.923 0.721 1.0 0.379 0.683 0.581 0.9 Compound_415 Oc1ccc(cc1)N(C(=O)c1cccc(c1C)F)c1ccc(cc1)O 0.936 0.67 0.66 0.617 0.986 0.974 0.938 0.651 0.459 0.799 0.593 Compound_416 CCOC(=O)C1(Cc2c(C1)ccc(c2)C1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O)C(=O)C 0.828 0.865 0.028 0.504 0.997 0.961 0.401 0.099 0.35 0.724 0.988 Compound_417 NCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.338 0.531 0.123 0.572 0.955 0.989 0.04 0.099 0.277 0.014 0.279 Compound_418 Cc1ccc(cc1)C1=C(Cc2c1ccc(c2)O)c1ccc(cc1)O 0.678 0.676 0.798 0.591 0.995 0.955 0.782 0.845 0.54 0.991 0.983 Compound_419 Oc1ccc(cc1)C1=C(c2ccc(cc2)Cl)c2c(C1)cc(cc2)O 0.621 0.72 0.571 0.619 0.999 0.936 0.955 0.891 0.426 0.99 1.002 Compound_420 CCC(=C(c1ccc(cc1)c1cnco1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.301 0.615 0.165 0.4 0.509 0.608 0.995 0.144 0.76 0.103 0.586 Compound_421 Oc1ccc(cc1)c1nn(c2c1cccc2Cl)C1CCCC1 0.463 0.671 0.925 0.748 0.882 0.727 0.098 0.981 0.766 0.502 0.868 Compound_422 Fc1ccc(cc1)C(=O)c1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.722 0.647 0.908 0.755 0.926 0.807 0.984 0.989 0.589 0.941 0.523 Compound_423 N#Cc1ccc(c(c1)Cl)C(=C(c1ccc2n(c1)ccn2)c1ccc(cc1)C=CC(=O)O)C1CCC1 0.689 0.52 0.13 0.409 0.773 0.661 0.959 0.325 0.406 0.471 0.648 Compound_424 Oc1ccc(cc1)C1=C(c2ccc(cc2)O)C2OC1C(C2)S(=O)(=O)Oc1ccc(cc1)C=Cc1cc(O)cc(c1)O 0.691 0.712 0.449 0.708 0.956 0.949 0.571 0.823 0.44 0.528 0.295 Compound_425 OCC12COC(C(C2)C(=CC1)C)c1ccc(cc1F)O 0.88 0.531 0.096 0.622 0.948 0.966 0.127 0.873 0.481 0.519 0.764 Compound_426 Oc1cccc(c1)c1n(Cc2ccc(cc2)OCCN2CCCCC2)c2c(c1C)cc(cc2)O 0.445 0.626 0.682 0.84 0.967 0.965 0.925 0.618 0.237 0.45 0.874 Compound_427 Oc1ccc2c(c1)CCN(C2c1ccc(cc1)OCCN1CCCCC1)c1cccc(c1)N(C)C 0.468 0.712 0.756 0.475 0.851 0.806 0.015 0.227 0.336 0.075 0.449 Compound_428 CNCCOc1ccc2c(c1)CCCC(=C2c1ccc(cc1)O)c1ccccc1 0.462 0.682 0.053 0.3 0.952 0.745 0.122 0.175 0.428 0.033 0.231 Compound_429 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCC1)Cc1ccccc1 0.421 0.605 0.131 0.576 0.935 0.991 0.02 0.369 0.408 0.901 0.275 Compound_430 FCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.541 0.296 0.009 0.865 0.971 0.98 0.005 0.861 0.408 0.02 0.151 Compound_431 Oc1ccc(c(c1)C)c1nn(c2c1cccc2C(F)(F)F)C(C)C 0.625 0.687 0.965 0.806 0.906 0.674 0.911 0.998 0.623 0.964 0.883 Compound_432 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1C)c1ccc(cc1)O 0.465 0.736 0.506 0.813 0.964 0.965 0.884 0.576 0.39 0.227 0.872 Compound_433 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCNCCCCCCCCCCCCCCCC)CCC 0.288 0.577 0.073 0.461 0.56 0.956 0.309 0.172 0.511 0.115 0.407 Compound_434 OC(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccc(cc1)O 0.634 0.647 0.179 0.493 0.987 0.994 0.955 0.967 0.732 0.927 0.881 Compound_435 Oc1ccc2c(c1)c(F)cc(c2)c1ccc(c(c1)F)O 0.968 0.615 0.932 0.702 0.987 0.968 0.987 0.988 0.899 0.991 0.972 Compound_436 CC1=CC(C)(C)C2(CC1C(OC2)c1ccc(cc1Cl)O)O 0.85 0.689 0.204 0.693 0.993 0.831 0.342 0.955 0.622 0.856 0.931 Compound_437 Oc1ccc(cc1)N(C(=O)c1ccc(c(c1)F)O)c1ccc(cc1)F 0.953 0.67 0.496 0.58 0.992 0.99 0.905 0.734 0.476 0.841 0.81 Compound_438 CCC(=C(c1ccc2c(c1)ncs2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.717 0.763 0.379 0.478 0.649 0.858 0.998 0.723 0.838 0.492 0.713 Compound_439 Oc1ccc(cc1)c1ccc2c(c1)cccc2O 0.953 0.847 0.961 0.844 0.965 0.993 0.821 0.991 0.952 0.918 0.949 Compound_440 Oc1ccc(cc1)c1cc(F)c2c(c1)ccc(c2)O 0.974 0.692 0.98 0.742 0.98 0.974 0.982 0.988 0.954 0.938 0.934 Compound_441 CN(CCOc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OC(=O)C)C 0.356 0.452 0.006 0.696 0.946 0.838 0.013 0.108 0.482 0.058 0.044 Compound_442 CCOC(=O)COc1ccc(cc1C)C(c1ccc(c(c1)C)O)(CCC)CCC 0.638 0.616 0.867 0.771 0.754 0.952 0.702 0.965 0.391 0.936 0.884 Compound_443 Brc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]cc2 0.313 0.35 0.68 0.513 0.594 0.663 0.271 0.91 0.32 0.798 0.581 Compound_444 N#Cc1c(c2ccc(cc2)O)n(c2c1cc(O)cc2)Cc1ccc(cc1)OCCN1CCCCCC1 0.655 0.572 0.816 0.875 0.968 0.805 0.916 0.663 0.427 0.637 0.967 Compound_445 CCC(=C(c1ccc2c(c1)oc(=O)[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.624 0.628 0.13 0.356 0.978 0.821 0.977 0.29 0.789 0.786 0.636 Compound_446 COc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)O)c1ccc(cc1)O 0.739 0.787 0.198 0.528 0.993 0.952 0.97 0.97 0.87 0.616 0.881 Compound_447 CCCN(S(=O)(=O)c1ccc(cc1)O)c1c(C)cccc1Cl 0.397 0.508 0.223 0.543 0.65 0.613 0.237 0.511 0.215 0.207 0.421 Compound_448 Oc1ccc(cc1)c1c(cc(n1C)c1ccc(cc1F)O)c1ccc(cc1)O 0.884 0.589 0.683 0.72 0.986 0.981 0.937 0.914 0.94 0.132 0.744 Compound_449 Oc1ccc(c(c1)F)c1ccc2c(c1)ccc(c2)O 0.975 0.649 0.949 0.718 0.98 0.974 0.982 0.984 0.78 0.976 0.931 Compound_450 Oc1ccc2c(c1)c(Cl)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.692 0.618 0.749 0.744 0.984 0.941 0.836 0.717 0.36 0.855 0.938 Compound_451 CCCCn1nc(c2c1c(Cl)ccc2)c1ccc(cc1)O 0.44 0.615 0.836 0.738 0.853 0.703 0.285 0.988 0.915 0.278 0.877 Compound_452 CCC(=C(c1ccccc1)c1ccc(cc1)OCC[N+](C(C)C)(C)C)c1ccccc1 0.223 0.469 0.063 0.666 0.833 0.99 0.003 0.786 0.15 0.003 0.2 Compound_453 N#Cc1cc(cc2c1cc(O)cc2)c1ccc(cc1F)O 0.975 0.641 0.941 0.709 0.99 0.816 0.973 0.993 0.858 0.771 0.971 Compound_454 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc3[nH]ncc3cc2C(=C1c1ccc(cc1)F)C 0.591 0.651 0.712 0.41 0.91 0.658 0.989 0.914 0.423 0.144 0.375 Compound_455 Oc1ccc2c(c1)ccc(c2)c1cc(F)c(cc1F)O 0.97 0.615 0.904 0.678 0.987 0.968 0.987 0.979 0.79 0.991 0.972 Compound_456 OCc1ccc(cc1)C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.818 0.873 0.035 0.376 0.993 0.988 0.262 0.151 0.132 0.95 0.741 Compound_457 CCC(=C(c1ccc2c(c1)cnn2C)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1Cl)F 0.705 0.717 0.451 0.364 0.957 0.656 0.999 0.586 0.845 0.867 0.728 Compound_458 NCCCc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.448 0.494 0.068 0.409 0.863 0.994 0.032 0.078 0.456 0.08 0.278 Compound_459 CCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCC1 0.278 0.684 0.069 0.544 0.89 0.888 0.092 0.324 0.172 0.757 0.144 Compound_460 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1cccc(c1)C#N 0.71 0.767 0.472 0.415 0.926 0.68 1.0 0.438 0.628 0.591 0.94 Compound_461 CCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.903 0.59 0.025 0.585 0.859 0.77 0.93 0.888 0.563 0.583 0.478 Compound_462 CCC(=C(c1ccc(cc1)c1csnc1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.79 0.692 0.165 0.4 0.694 0.933 0.999 0.144 0.76 0.57 0.72 Compound_463 CCCCN(CCOc1ccc(cc1)Cn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C)C 0.431 0.786 0.416 0.794 0.974 0.98 0.956 0.425 0.44 0.343 0.917 Compound_464 Oc1ccc2c(c1)c(Cl)c(n2Cc1ccc(cc1)OCCN1CCCCCC1)c1ccc(cc1)O 0.711 0.617 0.749 0.744 0.982 0.897 0.901 0.717 0.413 0.861 0.978 Compound_465 O=C(N1CCN(CC1)c1ccncc1)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.294 0.473 0.895 0.456 0.077 0.436 0.055 0.38 0.372 0.649 0.164 Compound_466 Oc1ccc(cc1)c1cc(Cl)c2c(c1)ccc(c2)O 0.958 0.783 0.98 0.742 0.993 0.963 0.927 0.988 0.946 0.947 0.992 Compound_467 Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)O 0.913 0.807 0.561 0.591 0.993 0.997 0.261 0.878 0.881 0.946 0.968 Compound_468 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccccc1 0.436 0.612 0.682 0.84 0.967 0.965 0.925 0.618 0.322 0.557 0.737 Compound_469 Oc1ccc(cc1)c1n(Cc2ccc(cc2)OCCN2CCCCCCC2)c2c(c1C)cc(cc2)O 0.505 0.636 0.718 0.901 0.974 0.979 0.956 0.658 0.408 0.59 0.481 Compound_470 Oc1ccc2c(c1)sc(c2c1ccc(cc1)F)C(=O)c1ccc(cc1)N(C)C 0.798 0.636 0.985 0.731 0.936 0.821 0.982 0.984 0.768 0.883 0.728 Compound_471 Oc1ccc(c(c1)O)c1nn(c2c1ccc(c2)O)c1cc(F)ccc1F 0.819 0.662 0.952 0.689 0.994 0.78 0.934 0.944 0.802 0.509 0.915 Compound_472 CCCCCCCCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN(C)C 0.629 0.563 0.003 0.688 0.924 0.925 0.03 0.137 0.076 0.365 0.181 Compound_473 Oc1ccc(cc1)c1oc(c(c1c1ccc(cc1)OCCN1CCCCC1)C)c1ccc(cc1)O 0.108 0.476 0.803 0.746 0.646 0.818 0.934 0.897 0.605 0.738 0.488 Compound_474 Cc1cc(C)c2c(c1)[nH]c(n2)c1cc2c(n1Cc1ccccc1)cccc2 0.253 0.645 0.993 0.538 0.532 0.772 0.998 0.857 0.588 0.349 0.361 Compound_475 CCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCCC1 0.294 0.609 0.069 0.544 0.854 0.736 0.033 0.425 0.161 0.431 0.061 Compound_476 Fc1ccc(cc1)c1c(Oc2ccc(c(c2)F)F)sc2c1ccc(c2)O 0.862 0.639 0.99 0.811 0.925 0.781 0.924 0.993 0.949 0.974 0.859 Compound_477 CCCc1c(oc(c1c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O)c1ccc(cc1)O 0.11 0.456 0.767 0.763 0.694 0.892 0.943 0.905 0.623 0.598 0.557 Compound_478 CCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN(C)C 0.356 0.496 0.003 0.688 0.926 0.898 0.026 0.103 0.089 0.037 0.083 Compound_479 NCCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.259 0.52 0.11 0.508 0.957 0.994 0.046 0.032 0.336 0.007 0.285 Compound_480 Oc1cc(F)c(c(c1)F)c1ccc2c(c1)ccc(c2Cl)O 0.971 0.637 0.943 0.765 0.983 0.826 0.953 0.98 0.724 0.992 0.993 Compound_481 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2(O)c1ccc2c(c1)COC2)C 0.905 0.817 0.017 0.431 1.003 0.992 0.649 0.244 0.367 0.991 0.927 Compound_482 OC(=O)C=Cc1ccc(cc1)C1N(CCc2c1ccc(c2)O)Cc1ccccc1 0.461 0.62 0.721 0.35 0.87 0.903 0.177 0.879 0.467 0.047 0.106 Compound_483 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccc(cc1)C#N 0.727 0.767 0.351 0.425 0.926 0.68 1.0 0.583 0.64 0.591 0.94 Compound_484 Oc1ccc(c(c1)Cl)c1ccc2c(c1)ccc(c2Cl)O 0.957 0.721 0.943 0.747 0.975 0.837 0.927 0.98 0.88 0.992 1.0 Compound_485 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)Cl)O 0.84 0.581 0.103 0.652 0.964 0.879 0.036 0.905 0.409 0.618 0.891 Compound_486 Fc1ccc(cc1)Oc1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.853 0.666 0.975 0.811 0.925 0.781 0.924 0.99 0.941 0.935 0.739 Compound_487 CCC(=C(c1ccc(cc1)c1cscn1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.702 0.746 0.153 0.434 0.605 0.952 0.999 0.425 0.669 0.142 0.773 Compound_488 CC1CCN(CC1)CCOc1ccc(cc1)Cn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C 0.436 0.736 0.684 0.872 0.968 0.966 0.94 0.819 0.379 0.227 0.872 Compound_489 Oc1ccc(cc1)c1nn(c2c1cccc2Cl)C1CCCCC1 0.544 0.627 0.925 0.748 0.905 0.749 0.19 0.981 0.882 0.659 0.855 Compound_490 CCC1=NC(C(N1)c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCCC1 0.292 0.444 0.113 0.467 0.105 0.332 0.006 0.288 0.228 0.075 0.184 Compound_491 Oc1ccc(c(c1)C)c1ccc2c(c1)ccc(c2Cl)O 0.917 0.722 0.966 0.761 0.98 0.87 0.858 0.997 0.773 0.993 0.991 Compound_492 Oc1ccc(cc1)c1cc(F)c2c(c1)ccc(c2Cl)O 0.977 0.637 0.978 0.771 0.98 0.838 0.927 0.987 0.923 0.992 0.993 Compound_493 CCN(CCOc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O)CC 0.458 0.744 0.801 0.853 0.974 0.98 0.956 0.796 0.17 0.146 0.88 Compound_494 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.535 0.64 0.867 0.768 0.974 0.935 0.943 0.671 0.393 0.645 0.64 Compound_495 Oc1ccc(c(c1)C)c1ccc2c(c1)ccc(c2)O 0.885 0.831 0.974 0.766 0.978 0.987 0.937 0.998 0.679 0.98 0.86 Compound_496 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCC)CCC 0.857 0.696 0.787 0.68 0.916 1.0 0.329 0.955 0.379 0.982 0.99 Compound_497 NC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.781 0.718 0.471 0.668 0.888 0.771 0.906 0.815 0.747 0.395 0.701 Compound_498 Oc1ccc(cc1)c1cc(Cl)c2c(c1)ccc(c2Cl)O 0.963 0.721 0.978 0.771 0.985 0.891 0.927 0.987 0.912 0.992 1.0 Compound_499 OCC12COC(C(C2)(C(=CC1)C)C)c1ccc(cc1Cl)O 0.776 0.649 0.217 0.671 0.986 0.891 0.013 0.897 0.433 0.479 0.837 Compound_500 OCc1nnc(o1)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.773 0.708 0.391 0.596 0.699 0.592 0.829 0.363 0.511 0.004 0.436 Compound_501 Clc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]cc2 0.26 0.377 0.68 0.513 0.675 0.678 0.44 0.91 0.276 0.863 0.494 Compound_502 N#Cc1cc(cc2c1cc(O)cc2)c1c(F)cc(cc1F)O 0.968 0.641 0.941 0.676 0.994 0.814 0.98 0.991 0.677 0.771 0.971 Compound_503 O=C(C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F)NCCC(F)(F)F 0.655 0.561 0.117 0.461 0.957 0.812 0.163 0.866 0.597 0.021 0.262 Compound_504 CCC(=C(c1ccccc1)c1ccc(cc1)OCC[N+](C)(C)C)c1ccccc1 0.237 0.366 0.063 0.683 0.859 0.991 0.006 0.786 0.082 0.004 0.138 Compound_505 O=C(c1ccc2c(c1)nc([nH]2)c1cc2c([nH]1)cccc2)c1ccccc1 0.574 0.753 0.964 0.531 0.551 0.75 0.983 0.809 0.528 0.456 0.97 Compound_506 OC1CCN(CC1)CCOc1ccc(cc1)Cn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C 0.424 0.573 0.642 0.816 0.952 0.938 0.759 0.581 0.329 0.93 0.834 Compound_507 CCCn1c(cc(c1c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1Cl)O 0.753 0.536 0.666 0.746 0.986 0.91 0.923 0.972 0.885 0.104 0.773 Compound_508 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)N1CCN(CC1)c1ccc(cc1)C)c1ccc(cc1)O 0.585 0.735 0.697 0.738 0.973 0.982 0.792 0.985 0.437 0.086 0.191 Compound_509 COc1cccc(c1)OS(=O)(=O)C1CC2OC1C(=C2c1ccc(cc1)O)c1ccc(cc1)C=Cc1cc(O)cc(c1)O 0.7 0.695 0.539 0.713 0.948 0.933 0.753 0.61 0.426 0.72 0.294 Compound_510 CCCCCCCCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCC1 0.522 0.689 0.069 0.544 0.889 0.921 0.107 0.425 0.141 0.776 0.244 Compound_511 CCCCCCCCNCCOc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.899 0.59 0.025 0.585 0.841 0.769 0.93 0.888 0.563 0.583 0.478 Compound_512 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1S(=O)(=O)C 0.655 0.707 0.654 0.44 0.878 0.688 0.997 0.408 0.416 0.441 0.474 Compound_513 O=C(N1CCC(CC1)c1ccccc1)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.495 0.409 0.605 0.351 0.204 0.344 0.131 0.472 0.571 0.521 0.18 Compound_514 CCCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccccc1 0.82 0.767 0.331 0.575 0.993 0.997 0.261 0.98 0.858 0.948 0.914 Compound_515 OCC12COC(C(C2)(C(=CC1)C)C)c1ccc(cc1F)O 0.855 0.609 0.217 0.671 0.945 0.966 0.087 0.897 0.477 0.422 0.689 Compound_516 Oc1ccc(c(c1)O)c1nn(c2c1ccc(c2)O)c1cccc(c1)Cl 0.813 0.728 0.944 0.669 0.99 0.796 0.807 0.923 0.538 0.522 0.964 Compound_517 CC(=CCc1c(O)cc(c2c1oc(cc2=O)c1ccc(cc1)O)O)C 0.914 0.815 0.924 0.769 0.961 0.995 0.977 0.998 0.888 0.044 0.758 Compound_518 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)OC(F)(F)F 0.418 0.649 0.743 0.79 0.989 0.915 0.984 0.562 0.294 0.289 0.858 Compound_519 CCC(=C(c1ccc(cc1)N1CCOCC1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.76 0.595 0.16 0.446 0.982 0.916 0.9 0.864 0.664 0.131 0.344 Compound_520 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1cccc(c1)C(F)(F)F 0.7 0.716 0.664 0.676 0.966 0.938 0.778 0.841 0.418 0.629 0.362 Compound_521 COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1F)ccc(c2)O 0.758 0.677 0.434 0.675 0.994 0.942 0.955 0.316 0.553 0.387 0.697 Compound_522 CNC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.639 0.765 0.837 0.779 0.862 0.737 0.943 0.966 0.654 0.672 0.599 Compound_523 CCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.259 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_524 OCCNC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.561 0.55 0.564 0.651 0.839 0.722 0.956 0.469 0.581 0.673 0.507 Compound_525 N#Cc1cc(O)c(c2c1cc(cc2)c1ccc(c(c1)F)O)Cl 0.983 0.629 0.935 0.749 0.98 0.674 0.886 0.998 0.681 0.91 0.997 Compound_526 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1cnc[nH]1)c1ccc(cc1)F 0.585 0.679 0.332 0.524 0.627 0.753 0.839 0.626 0.687 0.021 0.79 Compound_527 CCCc1nnc(o1)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.741 0.711 0.379 0.62 0.817 0.646 0.935 0.647 0.551 0.01 0.391 Compound_528 COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccc(cc1)C)ccc(c2)O 0.707 0.856 0.75 0.696 0.993 0.976 0.959 0.46 0.533 0.136 0.791 Compound_529 NCCOc1ccc(cc1)C(=C(c1ccccc1)Cn1cnnc1)c1ccc(cc1)O 0.22 0.601 0.217 0.566 0.456 0.905 0.696 0.079 0.288 0.012 0.275 Compound_530 CCC(=C(c1ccc2c(c1)cccc2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.711 0.535 0.15 0.415 0.973 0.954 0.989 0.789 0.834 0.974 0.928 Compound_531 COc1cc(ccc1OCCN1CCCCCC1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O 0.419 0.729 0.807 0.812 0.941 0.886 0.957 0.576 0.338 0.79 0.929 Compound_532 CN1CCN(CC1)C(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.532 0.758 0.883 0.554 0.846 0.953 0.16 0.925 0.511 0.026 0.23 Compound_533 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1cncn1C)c1ccc(cc1)F 0.656 0.72 0.48 0.706 0.811 0.835 0.824 0.438 0.795 0.005 0.691 Compound_534 Oc1ccc(c(c1)F)c1ccc2c(c1)ccc(c2Cl)O 0.978 0.637 0.943 0.747 0.98 0.838 0.927 0.98 0.896 0.992 0.993 Compound_535 N#Cc1ccc(cc1)C(=O)c1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.794 0.605 0.842 0.764 0.928 0.736 0.983 0.983 0.721 0.772 0.806 Compound_536 CC(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.709 0.579 0.633 0.708 0.977 0.992 0.513 0.954 0.953 0.952 0.829 Compound_537 C=CCn1nc(c2c1c(ccc2)C(F)(F)F)c1ccc(cc1C)O 0.584 0.664 0.975 0.81 0.899 0.634 0.885 0.997 0.397 0.033 0.756 Compound_538 CC1=CCC2(C(C1C(OC2)c1ccc(cc1)O)(C)C)O 0.857 0.657 0.398 0.658 0.973 0.961 0.68 0.931 0.505 0.816 0.863 Compound_539 CCc1c(c2ccc(cc2)OCCN2CCCCC2)c(oc1c1ccccc1)c1ccc(cc1)O 0.08 0.492 0.735 0.741 0.64 0.894 0.933 0.846 0.612 0.053 0.276 Compound_540 CCCN(S(=O)(=O)c1ccc(c(c1)C(F)(F)F)O)c1ccccc1Br 0.654 0.503 0.548 0.661 0.656 0.669 0.942 0.953 0.335 0.688 0.581 Compound_541 CN(CCOc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O)C 0.457 0.788 0.423 0.805 0.974 0.97 0.953 0.72 0.291 0.038 0.657 Compound_542 Oc1ccc(cc1)c1cc(c(n1C)c1ccc(cc1F)O)c1ccc(cc1)O 0.884 0.589 0.683 0.72 0.986 0.981 0.937 0.914 0.94 0.132 0.744 Compound_543 CCCCCCNCCOc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.883 0.59 0.025 0.585 0.843 0.75 0.92 0.888 0.535 0.583 0.478 Compound_544 Fc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)C(F)(F)F)ccc(c2)O 0.937 0.637 0.859 0.812 0.94 0.794 0.987 0.992 0.585 0.966 0.686 Compound_545 OCC=Cc1cc2c(c(c1)OC)OC(C2CO)c1ccc(c(c1)OC)O 0.586 0.691 0.171 0.731 0.831 0.17 0.056 0.753 0.337 0.739 0.933 Compound_546 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1ccc(cc1)Cl 0.726 0.742 0.653 0.675 0.933 0.931 0.236 0.892 0.427 0.669 0.357 Compound_547 CCOc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.404 0.677 0.54 0.901 0.967 0.965 0.925 0.68 0.258 0.236 0.869 Compound_548 CCCC(c1ccc(c(c1)O)O)(c1ccc(cc1)O)CCC 0.976 0.691 0.656 0.58 0.972 0.613 0.78 0.99 0.197 0.99 0.949 Compound_549 Oc1ccc(c(c1)Cl)C1N=CNC1c1c(Cl)cc(cc1Cl)O 0.302 0.681 0.254 0.519 0.619 0.689 0.018 0.176 0.364 0.564 0.928 Compound_550 CCc1c(oc(c1c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O)c1ccc(cc1)O 0.079 0.466 0.767 0.761 0.636 0.883 0.943 0.891 0.604 0.618 0.6 Compound_551 CCC(c1ccc(cn1)O)Cc1ccc(cc1)O 0.252 0.701 0.25 0.532 0.332 0.692 0.005 0.498 0.399 0.127 0.866 Compound_552 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)N1CCCC1)c1ccc(cc1)O 0.483 0.653 0.795 0.759 0.899 0.991 0.751 0.979 0.61 0.342 0.461 Compound_553 OCC12COC(C(C2)(C(=CC1)C)C)c1ccc(c(c1)F)O 0.822 0.609 0.23 0.717 0.945 0.966 0.087 0.926 0.413 0.422 0.689 Compound_554 Fc1ccc(cc1)C(=O)Nc1ccc2c(c1)[nH]cc2 0.598 0.782 0.997 0.789 0.636 0.696 0.32 0.953 0.704 0.981 0.896 Compound_555 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc2c(c1)OCO2 0.434 0.769 0.95 0.84 0.933 0.88 0.927 0.754 0.347 0.837 0.814 Compound_556 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1C(C)CCCC1C)c1ccc(cc1)O 0.496 0.752 0.476 0.783 0.964 0.965 0.884 0.692 0.341 0.731 0.895 Compound_557 O=C(N1CCN(CC1)c1cccc2c1cccc2)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.401 0.426 0.715 0.493 0.35 0.535 0.778 0.586 0.447 0.535 0.146 Compound_558 O=C(N1CCN(CC1)c1ccccc1O)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.405 0.422 0.306 0.419 0.396 0.491 0.018 0.153 0.45 0.398 0.121 Compound_559 COCCCCCCC1CC2C3CCC(C3CCC2c2c1cc(O)cc2)O 0.959 0.597 0.016 0.548 0.983 0.99 0.089 0.382 0.208 0.898 0.744 Compound_560 OC(=O)C=CC=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.673 0.552 0.322 0.565 0.986 0.988 0.955 0.928 0.942 0.959 0.866 Compound_561 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1C1=CCNCC1)C)O 0.656 0.521 0.099 0.472 0.415 0.628 0.025 0.959 0.242 0.095 0.417 Compound_562 CCC(=C(c1ccc(cc1)N)c1ccc(cc1)N)c1ccc(cc1)N(=O)=O 0.922 0.637 0.616 0.519 0.929 0.975 1.0 0.951 0.729 0.992 0.949 Compound_563 O=Cc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.924 0.621 0.79 0.745 0.954 0.99 0.994 0.995 0.656 0.955 0.94 Compound_564 C#Cc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.905 0.615 0.931 0.676 0.953 0.913 0.982 0.995 0.737 0.991 0.932 Compound_565 Brc1ccc2c(c1)nc([nH]2)c1cc2c(n1Cc1ccccc1)cccc2 0.392 0.623 0.992 0.51 0.597 0.652 0.991 0.67 0.518 0.775 0.265 Compound_566 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)N1CCN(CC1)Cc1ccccc1)c1ccc(cc1)O 0.557 0.702 0.866 0.577 0.894 0.979 0.765 0.943 0.503 0.152 0.26 Compound_567 CCC(=C(c1ccc2n(c1)ccn2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.486 0.715 0.049 0.314 0.596 0.861 0.986 0.201 0.36 0.134 0.543 Compound_568 Oc1ccc2c(c1)oc(=O)c1c2oc2c1ccc(c2)O 0.464 0.525 0.979 0.661 0.785 0.777 0.977 0.958 0.95 0.913 0.671 Compound_569 Fc1ccc(cc1)c1c(Oc2ccc(cc2)Cl)sc2c1ccc(c2)O 0.854 0.692 0.975 0.811 0.876 0.766 0.514 0.99 0.763 0.943 0.864 Compound_570 Clc1cc2[nH]c(nc2cc1Cl)c1cc2c(n1Cc1ccccc1)cccc2 0.466 0.606 0.979 0.545 0.582 0.731 0.973 0.885 0.577 0.766 0.332 Compound_571 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2F)O 0.97 0.615 0.949 0.776 0.98 0.974 0.982 0.992 0.932 0.991 0.972 Compound_572 OC(=O)C=Cc1ccc(cc1)C1(C(F)F)N(CCc2c1ccc(c2)O)c1ccc(cc1)C(C)C 0.783 0.624 0.167 0.407 0.991 0.917 0.891 0.899 0.666 0.009 0.292 Compound_573 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCNCCCCCC)CCC 0.246 0.577 0.073 0.461 0.468 0.949 0.309 0.172 0.461 0.115 0.407 Compound_574 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCN)CCC 0.518 0.644 0.392 0.56 0.693 0.989 0.33 0.179 0.273 0.066 0.576 Compound_575 Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.436 0.403 0.888 0.522 0.509 0.648 0.038 0.575 0.343 0.198 0.36 Compound_576 Oc1ccc(cc1)c1cc(cc(c1)c1ccc(cc1)O)c1ccc(cc1)O 0.958 0.827 0.924 0.853 0.996 0.995 0.927 0.974 0.891 0.354 0.82 Compound_577 COc1cc(ccc1OCCN1CCCCC1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O 0.395 0.736 0.807 0.812 0.912 0.931 0.927 0.576 0.253 0.348 0.928 Compound_578 CCCN(CCOc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O)CCC 0.422 0.728 0.58 0.872 0.974 0.98 0.956 0.758 0.381 0.671 0.892 Compound_579 N#Cc1ccc(cc1)N1CCN(CC1)C(=O)CCC(n1c(=S)[nH]c2c(c1=O)cccc2)C(=O)OC(C)(C)C 0.55 0.558 0.191 0.455 0.643 0.362 0.16 0.731 0.414 0.984 0.431 Compound_580 CC(Oc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCCC1)ccc(c2)O)C 0.435 0.704 0.606 0.901 0.975 0.913 0.925 0.774 0.425 0.653 0.729 Compound_581 CC(Oc1ccc(cc1)c1n(Cc2ccc(cc2)OC2C=CC=C2)c2c(c1C)cc(cc2)O)C 0.679 0.689 0.955 0.757 0.981 0.949 0.859 0.989 0.608 0.713 0.749 Compound_582 Brc1ccc2c(c1)nc([nH]2)c1cc2c([nH]1)cccc2 0.597 0.703 0.954 0.537 0.592 0.652 0.958 0.29 0.547 0.799 0.749 Compound_583 CCCCCCCCCC(=O)Oc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)OCCN1CCCCC1 0.505 0.6 0.069 0.544 0.812 0.762 0.039 0.425 0.142 0.414 0.113 Compound_584 CCC(=C(c1ccc(cc1)c1nccs1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.684 0.746 0.153 0.434 0.527 0.912 0.997 0.425 0.77 0.142 0.646 Compound_585 N#Cc1cc(O)cc2c1cc(cc2)c1ccc(cc1)O 0.967 0.849 0.961 0.774 0.992 0.861 0.973 0.997 0.859 0.819 0.979 Compound_586 Oc1cc(Cl)c(c(c1)Cl)C1N=CNC1c1ccc(cc1Cl)OCCN1CCCCC1 0.442 0.519 0.023 0.531 0.629 0.694 0.005 0.256 0.26 0.361 0.392 Compound_587 N#CC(=C(c1ccccc1)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.359 0.268 0.004 0.788 0.957 0.736 0.011 0.281 0.433 0.017 0.252 Compound_588 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCCC)CCC 0.82 0.714 0.731 0.665 0.916 1.0 0.329 0.914 0.557 0.983 0.997 Compound_589 NCCOc1ccc(cc1)C(=C(c1ccc(cc1)F)CC)c1ccc(cc1)O 0.355 0.503 0.299 0.62 0.959 0.98 0.05 0.266 0.511 0.027 0.31 Compound_590 CC#CC1(O)CCC2(C(C1)CCc1c2ccc(c1)O)CC 0.959 0.763 0.09 0.581 0.97 0.992 0.615 0.523 0.32 0.999 0.928 Compound_591 CCOc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCCC1)ccc(c2)O 0.435 0.692 0.54 0.901 0.977 0.926 0.956 0.68 0.35 0.348 0.869 Compound_592 CCC(=C(c1ccc(cc1)C=CC(=O)O)c1ccc(cc1)N1CCN(CC1)C)c1ccccc1 0.516 0.646 0.052 0.454 0.956 0.975 0.81 0.288 0.552 0.079 0.312 Compound_593 N#Cc1cccc(c1)N1CCN(CC1)C(=O)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.467 0.406 0.759 0.523 0.421 0.354 0.516 0.745 0.415 0.535 0.535 Compound_594 N#Cc1ccccc1N1CCN(CC1)C(=O)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.474 0.406 0.512 0.495 0.488 0.365 0.122 0.687 0.416 0.535 0.535 Compound_595 Oc1ccc(cc1)C1=Cc2c(C31C(=O)c1c(C3=O)cccc1)ccc(c2)O 0.693 0.793 0.619 0.631 0.996 0.982 0.857 0.973 0.381 0.475 1.001 Compound_596 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2Cl)O 0.958 0.721 0.949 0.776 0.983 0.884 0.927 0.992 0.906 0.992 1.0 Compound_597 Oc1ccc2c(c1)ccc(c2)c1ccc(c(c1)F)O 0.97 0.615 0.914 0.706 0.98 0.974 0.982 0.991 0.678 0.991 0.972 Compound_598 Oc1ccc2c(c1)ccc(c2)c1cc(F)c(c(c1)F)O 0.961 0.615 0.934 0.706 0.987 0.968 0.987 0.991 0.629 0.991 0.972 Compound_599 OCC12COC(C(C2)C(=CC1)C)c1ccc(cc1C)O 0.873 0.644 0.213 0.591 0.947 0.927 0.049 0.878 0.375 0.447 0.846 Compound_600 Cc1ccc(cc1)S(=O)(=O)N1Cc2c(C1)ccc(c2)C1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.702 0.814 0.026 0.442 0.92 0.858 0.066 0.175 0.366 0.248 0.309 Compound_601 C=CCC12CCC(CC1CCc1c2ccc(c1)O)(O)C#CC 0.942 0.741 0.151 0.656 0.97 0.992 0.615 0.909 0.186 0.996 0.709 Compound_602 OCCn1nc(c2c1c(ccc2)C(F)(F)F)c1ccc(cc1)O 0.576 0.677 0.694 0.791 0.908 0.678 0.903 0.906 0.473 0.012 0.791 Compound_603 N#Cc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.977 0.601 0.949 0.735 0.99 0.816 0.973 0.995 0.725 0.898 0.987 Compound_604 N#CC(=C(c1ccccc1)c1ccc(cc1)OCCN1CCOCC1)c1ccccc1 0.345 0.611 0.085 0.631 0.962 0.598 0.098 0.817 0.287 0.715 0.612 Compound_605 N#Cc1cc(O)c(c2c1cc(cc2)c1ccc(cc1)O)Cl 0.975 0.713 0.961 0.744 0.982 0.69 0.886 0.997 0.801 0.91 1.001 Compound_606 Oc1ccc(cc1)c1n(Cc2ccc(cc2)OCCCN2CCCCC2)c2c(c1C)cc(cc2)O 0.376 0.595 0.779 0.846 0.97 0.978 0.914 0.779 0.365 0.205 0.893 Compound_607 CCC(=C(c1ccc(cc1)c1n[nH]cc1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.644 0.768 0.426 0.404 0.914 0.738 0.999 0.259 0.659 0.229 0.846 Compound_608 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1ccccc1)C)N1CCOCC1 0.585 0.668 0.174 0.449 0.958 0.782 0.131 0.917 0.334 0.33 0.537 Compound_609 CCC1=C(c2ccc(cc2)O)C(c2c1ccc(c2)O)C(=O)Nc1ccc(cc1)OCCN1CCCCC1 0.654 0.717 0.243 0.589 0.911 0.842 0.168 0.531 0.244 0.855 0.592 Compound_610 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN(C(C)C)C(C)C)c1ccc(cc1)O 0.446 0.76 0.817 0.783 0.972 0.98 0.94 0.761 0.292 0.142 0.737 Compound_611 CC(Oc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O)C 0.404 0.728 0.606 0.901 0.971 0.956 0.874 0.774 0.385 0.638 0.692 Compound_612 Oc1ccc(cc1)c1c(cc(n1C)c1ccc(cc1Cl)O)c1ccc(cc1)O 0.864 0.673 0.683 0.72 0.988 0.914 0.926 0.914 0.928 0.221 0.912 Compound_613 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCCC1)c1ccc(cc1)F 0.563 0.645 0.867 0.768 0.978 0.911 0.964 0.671 0.428 0.748 0.766 Compound_614 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCC[N+](C)(C)C)c1ccc(cc1)O 0.457 0.812 0.697 0.797 0.974 0.97 0.953 0.98 0.165 0.019 0.437 Compound_615 CCC(=C(c1ccc2c(c1)sc(=O)[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.52 0.591 0.13 0.356 0.951 0.869 0.987 0.29 0.505 0.345 0.629 Compound_616 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=CC(=O)c1ccccc1)c1ccc(cc1)O 0.741 0.589 0.644 0.77 0.977 0.987 0.96 0.979 0.939 0.912 0.915 Compound_617 Oc1ccc(cc1)c1nn(c2c1cccc2Cl)Cc1ccccc1 0.561 0.722 0.98 0.761 0.91 0.742 0.905 0.982 0.902 0.267 0.907 Compound_618 N#Cc1cc(cc2c1cc(O)cc2)c1ccc(cc1)O 0.962 0.849 0.955 0.755 0.992 0.861 0.973 0.996 0.869 0.819 0.979 Compound_619 Oc1ccc2c(c1)ccc(c2)c1ccc(c(c1)Cl)O 0.951 0.721 0.914 0.706 0.979 0.908 0.951 0.991 0.668 0.992 1.0 Compound_620 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1ccccc1Cl 0.739 0.74 0.65 0.673 0.936 0.886 0.29 0.843 0.433 0.744 0.332 Compound_621 CCCN(S(=O)(=O)c1ccc(c(c1)C)O)c1ccccc1C 0.474 0.559 0.477 0.553 0.294 0.703 0.54 0.2 0.209 0.133 0.226 Compound_622 N#Cc1cc(cc2c1c(Cl)c(cc2)O)c1ccc(cc1)O 0.953 0.713 0.946 0.684 0.983 0.701 0.895 0.992 0.83 0.91 1.001 Compound_623 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1cnccc1C 0.407 0.729 0.689 0.444 0.839 0.707 0.996 0.236 0.616 0.101 0.846 Compound_624 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C 0.459 0.631 0.751 0.901 0.968 0.971 0.938 0.66 0.33 0.333 0.751 Compound_625 O=C1CCC2(C(=C1c1ccc(cc1)OCCN1CCCCC1)c1ccc3c(c1C2)cn[nH]3)Cc1ccccc1 0.679 0.682 0.516 0.465 0.917 0.722 0.994 0.596 0.367 0.055 0.376 Compound_626 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(nc1)C=CC(=O)O)c1ccccc1 0.654 0.769 0.732 0.456 0.837 0.704 0.996 0.54 0.43 0.107 0.819 Compound_627 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)Cl 0.469 0.666 0.867 0.768 0.971 0.914 0.882 0.671 0.296 0.744 0.873 Compound_628 Oc1ccc(c(c1)C)c1c(=O)oc2c(c1C)ccc(c2)O 0.793 0.828 0.96 0.647 0.947 0.939 0.99 0.978 0.842 0.332 0.875 Compound_629 CCCCn1nc(c2c1cc(O)cc2)c1ccc(cc1O)O 0.625 0.522 0.799 0.729 0.938 0.703 0.449 0.978 0.806 0.15 0.777 Compound_630 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1nnn(n1)C)c1ccc(cc1)F 0.745 0.691 0.437 0.576 0.754 0.808 0.599 0.584 0.795 0.005 0.518 Compound_631 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1nnc(o1)C)c1ccc(cc1)F 0.76 0.709 0.522 0.641 0.839 0.651 0.932 0.762 0.548 0.005 0.291 Compound_632 CCc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.852 0.553 0.858 0.699 0.974 0.966 0.937 0.987 0.767 0.995 0.856 Compound_633 N#Cc1cc(O)c(c2c1cc(cc2)c1ccc(c(c1)F)O)Br 0.989 0.593 0.935 0.749 0.693 0.668 0.981 0.998 0.534 0.959 0.991 Compound_634 Oc1ccc2c(c1)ccc(c2c1ccccc1)c1ccccc1 0.953 0.827 0.966 0.809 0.993 0.988 0.873 0.992 0.896 0.988 0.919 Compound_635 Fc1cc(O)c(cc1c1ccc2c(c1)ccc(c2Cl)O)F 0.974 0.637 0.851 0.71 0.983 0.826 0.953 0.986 0.907 0.992 0.993 Compound_636 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C(F)(F)F 0.714 0.658 0.215 0.438 0.991 0.91 0.859 0.93 0.659 0.019 0.578 Compound_637 O=C(N1CCN(CC1)c1ncccn1)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.358 0.437 0.293 0.392 0.098 0.506 0.08 0.429 0.355 0.649 0.251 Compound_638 Oc1cc2OC(=O)C(Cc2c(c1)Cc1ccccc1)c1ccc(cc1)Cl 0.467 0.546 0.884 0.616 1.0 0.893 0.827 0.77 0.262 0.857 0.457 Compound_639 O=C(N1CCC(CC1)N(c1ccccc1)Cc1ccccc1)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.648 0.385 0.67 0.475 0.522 0.853 0.247 0.699 0.341 0.868 0.166 Compound_640 Clc1cccc(c1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.397 0.353 0.929 0.532 0.522 0.647 0.62 0.87 0.434 0.676 0.215 Compound_641 CNC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.649 0.722 0.405 0.528 0.854 0.86 0.129 0.808 0.582 0.044 0.36 Compound_642 Oc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCC1)cccc2 0.43 0.612 0.616 0.84 0.955 0.963 0.96 0.616 0.242 0.557 0.737 Compound_643 COc1cccc(c1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.429 0.706 0.755 0.832 0.967 0.965 0.925 0.425 0.272 0.052 0.816 Compound_644 Clc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)C(F)(F)F)ccc(c2)O 0.921 0.671 0.859 0.812 0.956 0.805 0.983 0.992 0.529 0.972 0.835 Compound_645 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1N(C)C 0.896 0.774 0.92 0.583 0.885 0.738 0.97 0.914 0.763 0.942 0.77 Compound_646 OC(=O)C=Cc1ccc(cc1)C1(N(CCc2c1ccc(c2)O)c1ccc(cc1)C(C)C)C(F)(F)F 0.775 0.621 0.167 0.438 0.991 0.917 0.891 0.886 0.605 0.012 0.29 Compound_647 Oc1ccc(cc1F)c1cc(F)c2c(c1)ccc(c2Cl)O 0.972 0.637 0.893 0.732 0.983 0.826 0.953 0.993 0.877 0.992 0.993 Compound_648 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2ccccc2)C2OC1CC2S(=O)(=O)Oc1ccccc1 0.7 0.722 0.402 0.722 0.939 0.979 0.277 0.45 0.412 0.515 0.306 Compound_649 N#Cc1cc(cc2c1c(Br)c(cc2)O)c1ccc(cc1)O 0.979 0.695 0.946 0.684 0.688 0.739 0.981 0.992 0.766 0.959 0.998 Compound_650 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)C)O 0.863 0.644 0.179 0.677 0.871 0.99 0.137 0.861 0.453 0.447 0.846 Compound_651 CCC(=C(c1ccc2c(c1)cnn2C)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.679 0.716 0.128 0.384 0.931 0.683 0.999 0.702 0.821 0.862 0.766 Compound_652 O=C1CCC2(C(=C1C)c1ccc3c(c1C2)cn[nH]3)Cc1ccccc1F 0.78 0.816 0.929 0.592 0.864 0.703 0.959 0.967 0.61 0.305 0.69 Compound_653 CC1=CC(C)(C)C2(CC1C(OC2)c1ccc(cc1)O)O 0.871 0.657 0.398 0.693 0.978 0.952 0.676 0.935 0.438 0.816 0.863 Compound_654 Oc1ccc(cc1F)c1ccc2c(c1)ccc(c2Cl)O 0.974 0.637 0.866 0.739 0.98 0.838 0.927 0.995 0.797 0.992 0.993 Compound_655 CC1=CCC2CC1C(OC2(C)C)c1ccc(c(c1)C)O 0.914 0.579 0.257 0.57 0.922 0.975 0.213 0.857 0.523 0.994 0.963 Compound_656 Oc1ccc2c(c1)OC(C1=C2CCOc2c1cccc2)c1ccc(cc1)OCCN1CCCCCC1 0.582 0.766 0.232 0.463 0.942 0.743 0.229 0.204 0.35 0.931 0.18 Compound_657 NCCOc1ccc(cc1)C(=C(c1ccc(cc1)O)CC)c1ccc(cc1)N 0.53 0.562 0.546 0.601 0.989 0.996 0.079 0.314 0.415 0.017 0.684 Compound_658 OC(=O)CCCOc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.559 0.483 0.458 0.584 0.979 0.934 0.905 0.202 0.65 0.887 0.514 Compound_659 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1cccc(c1)Cl 0.737 0.742 0.692 0.678 0.962 0.887 0.29 0.85 0.417 0.669 0.357 Compound_660 CCCN1C=NC(C1c1ccc(cc1Cl)O)c1ccc(cc1Cl)O 0.213 0.534 0.43 0.572 0.683 0.756 0.001 0.234 0.266 0.217 0.571 Compound_661 Oc1ccc(cc1)C(=Cc1ccccc1)c1ccc(cc1)O 0.892 0.83 0.756 0.696 0.995 1.0 0.888 0.921 0.888 0.798 0.991 Compound_662 O=S1C2C3C(C1C(=C2c1ccc(cc1C)O)c1ccc(cc1C)O)C(=O)N(C3=O)c1ccccc1 0.754 0.864 0.645 0.518 0.964 0.759 0.734 0.52 0.478 0.995 0.509 Compound_663 CCc1c(c2ccc(cc2)O)n(c2c1cc(O)cc2)Cc1ccc(cc1)OCCN1CCCCC1 0.44 0.625 0.624 0.837 0.967 0.965 0.925 0.635 0.348 0.48 0.887 Compound_664 CCC(=C(c1ccc2c(c1)nc(s2)C)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.701 0.766 0.822 0.516 0.723 0.862 0.999 0.907 0.819 0.467 0.776 Compound_665 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCC(C1)(C)C)c1ccc(cc1)O 0.45 0.814 0.494 0.882 0.972 0.97 0.925 0.675 0.431 0.856 0.871 Compound_666 Oc1ccc(cc1)c1n(Cc2ccc(cc2)OCCN2CC3(CC2C(C3)(C)C)C)c2c(c1C)cc(cc2)O 0.467 0.814 0.604 0.758 0.755 0.7 0.94 0.703 0.343 0.856 0.871 Compound_667 CCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.204 0.48 0.017 0.376 0.875 0.976 0.038 0.137 0.536 0.396 0.201 Compound_668 CCC1=C(c2ccc(cc2)O)C(c2c1ccc(c2)O)C(=O)Nc1ccc(cc1)OCCN(C)C 0.62 0.725 0.014 0.627 0.932 0.865 0.126 0.255 0.196 0.536 0.625 Compound_669 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1ccc(cc1)c1ccccc1 0.72 0.712 0.501 0.713 0.951 0.94 0.673 0.94 0.43 0.528 0.295 Compound_670 CCC(c1ccc(c(c1)O)O)(c1ccc(cc1)O)CC 0.971 0.618 0.656 0.614 0.972 0.613 0.78 0.992 0.199 0.976 0.937 Compound_671 CCC1=C(c2ccc(cc2)O)C(c2c1ccc(c2)O)C(=O)O 0.442 0.644 0.009 0.18 0.977 0.7 0.899 0.184 0.175 0.995 0.882 Compound_672 CCCC(c1ccc(c(c1)O)O)(c1ccc(c(c1)C)O)CCC 0.952 0.711 0.729 0.586 0.923 0.771 0.107 0.991 0.239 0.994 0.944 Compound_673 COc1ccc2c(c1)CC(N(C2c1ccc(cc1)C=CC(=O)O)CC(C)C)C 0.385 0.706 0.176 0.272 0.336 0.896 0.062 0.49 0.542 0.055 0.11 Compound_674 CCC(C1=CCC2C1(C)CCC1C2CCc2c1ccc(c2)O)C 0.972 0.799 0.034 0.535 0.981 0.958 0.162 0.929 0.37 1.0 1.001 Compound_675 CCC(=C(c1ccc2c(c1)cn[nH]2)c1ccc(cc1)C=CC(=O)O)c1cccnc1C 0.423 0.729 0.648 0.406 0.841 0.712 0.996 0.477 0.586 0.101 0.846 Compound_676 CC1CC(C2(O1)CCC1C2(C)CCC2C1CCc1c2ccc(c1)O)C 0.971 0.796 0.006 0.441 0.996 0.996 0.239 0.474 0.106 0.999 0.966 Compound_677 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCC(C)C)CCC 0.82 0.644 0.971 0.665 0.92 0.997 0.389 0.723 0.142 0.984 0.982 Compound_678 NC(=O)CNc1ccc(cc1)C(=C(c1ccc(cc1)N(=O)=O)C)c1ccc(cc1)N 0.801 0.577 0.148 0.291 0.865 0.842 0.244 0.064 0.537 0.516 0.312 Compound_679 Oc1ccc(c(c1)O)c1nn(c2c1ccc(c2)O)CC(F)(F)F 0.738 0.663 0.981 0.802 0.959 0.623 0.883 0.987 0.669 0.018 0.916 Compound_680 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCCCCC)CCC 0.858 0.714 0.731 0.665 0.916 1.0 0.329 0.956 0.675 0.983 0.997 Compound_681 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1cccc(c1)C 0.713 0.695 0.584 0.699 0.947 0.954 0.736 0.781 0.42 0.717 0.28 Compound_682 Oc1ccc2c(c1)cc1c(c2)nc2c(c1c1ccccc1)cccc2 0.931 0.813 0.967 0.84 0.997 0.947 0.988 0.989 0.657 0.979 0.961 Compound_683 O=C(N1CCN(CC1)Cc1cccc2c1cccc2)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.355 0.395 0.684 0.372 0.355 0.522 0.467 0.277 0.453 0.844 0.159 Compound_684 Oc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(F)(F)F 0.53 0.629 0.771 0.791 0.988 0.924 0.987 0.774 0.284 0.482 0.836 Compound_685 CC(CN1CCc2c(C1c1ccc(cc1)C=CC(=O)O)ccc(c2C)O)C 0.591 0.702 0.17 0.362 0.418 0.927 0.026 0.774 0.532 0.122 0.074 Compound_686 CC1CCCN(C1)CCOc1ccc(cc1)Cn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O 0.45 0.736 0.569 0.851 0.968 0.966 0.94 0.774 0.38 0.227 0.872 Compound_687 Oc1ccc2c(c1)C=C(C12C(=O)c2c(C1=O)cc(cc2)OCCN1CCCCC1)c1ccc(cc1)O 0.604 0.757 0.217 0.645 0.959 0.772 0.519 0.953 0.356 0.816 0.795 Compound_688 OCC12COC(C(C2)C(=CC1)C)c1ccc(cc1O)O 0.788 0.573 0.178 0.616 0.951 0.973 0.181 0.915 0.308 0.36 0.583 Compound_689 COc1cc(O)ccc1c1ccc2c(c1)ccc(c2)O 0.952 0.835 0.948 0.739 0.974 0.983 0.668 0.992 0.758 0.605 0.894 Compound_690 O=C(N1CCC(CC1)Nc1ccccc1)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.505 0.351 0.84 0.342 0.137 0.629 0.052 0.57 0.393 0.848 0.124 Compound_691 CC#Cc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.842 0.616 0.892 0.717 0.957 0.979 0.937 0.994 0.674 0.994 0.874 Compound_692 N#Cc1cc(cc2c1cc(O)cc2)c1cc(F)c(cc1F)O 0.97 0.601 0.932 0.675 0.994 0.814 0.98 0.989 0.867 0.898 0.987 Compound_693 CCC(=C(c1ccc(cc1)N1CCCCC1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.601 0.567 0.06 0.424 0.973 0.963 0.827 0.849 0.812 0.223 0.319 Compound_694 Cc1cccc2c1nc([nH]2)c1cc2c([nH]1)cccc2 0.229 0.736 0.978 0.532 0.517 0.778 0.952 0.875 0.53 0.455 0.927 Compound_695 CC(CCCC1Cc2cc(O)ccc2C2C1C1CCC(C1(CC2)C)O)CCCC(CCCC(C)C)C 0.97 0.9 0.155 0.61 0.993 0.995 0.054 0.446 0.024 0.999 0.825 Compound_696 CCOC(=O)C=Cc1ccc(cc1C)C(c1ccc(c(c1)C)O)(CCC)CCC 0.971 0.653 0.891 0.779 0.97 1.0 0.591 0.977 0.665 0.99 0.898 Compound_697 CCCC(c1ccc(c(c1)C)O)(c1ccc([nH]1)C(=O)OCC)CCC 0.555 0.632 0.387 0.585 0.787 0.693 0.705 0.086 0.412 0.05 0.803 Compound_698 Oc1ccc(cc1)c1nn(c2c1cccc2C(F)(F)F)Cc1ccccc1 0.604 0.683 0.978 0.781 0.957 0.812 0.971 0.992 0.786 0.063 0.907 Compound_699 Fc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.559 0.64 0.867 0.768 0.967 0.924 0.97 0.671 0.385 0.645 0.64 Compound_700 Oc1ccc(cc1)c1c(Oc2ccc(cc2)OCCN2CCCCC2)oc2c(c1=O)ccc(c2)O 0.737 0.698 0.718 0.621 0.957 0.836 0.624 0.932 0.351 0.839 0.581 Compound_701 CCCCN(CCOc1ccc(cc1)Cn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C)CCCC 0.452 0.77 0.54 0.891 0.979 0.98 0.956 0.708 0.449 0.706 0.908 Compound_702 CCC(=C(c1ccc2c(c1)cns2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.728 0.71 0.224 0.402 0.699 0.787 0.999 0.678 0.783 0.845 0.666 Compound_703 c1ccc2c(c1)cc([nH]2)c1nc2cccc3c2c([nH]1)ccc3 0.54 0.748 0.977 0.479 0.863 0.807 0.804 0.909 0.95 0.357 0.692 Compound_704 OCC12COC(C(C2)(C(=CC1)C)C)c1ccc(cc1)O 0.8 0.669 0.308 0.666 0.943 0.983 0.087 0.892 0.271 0.449 0.658 Compound_705 CC1=CCC2CC1C(OC2(C)C)c1ccc(cc1)O 0.911 0.596 0.204 0.537 0.97 0.953 0.378 0.857 0.338 0.993 0.923 Compound_706 Cc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]cc2 0.226 0.389 0.669 0.361 0.666 0.658 0.281 0.812 0.352 0.455 0.341 Compound_707 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C 0.703 0.718 0.318 0.508 0.975 0.957 0.712 0.862 0.669 0.004 0.543 Compound_708 OCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.31 0.522 0.006 0.345 0.869 0.965 0.014 0.042 0.235 0.288 0.126 Compound_709 N#Cc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.976 0.601 0.94 0.72 0.99 0.816 0.973 0.994 0.824 0.898 0.987 Compound_710 Nc1ccc(cc1)C(=C(c1ccc(cc1)N(=O)=O)C)c1ccc(cc1)N 0.951 0.582 0.861 0.524 0.929 0.975 1.0 0.941 0.766 0.992 0.942 Compound_711 CCC(=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O)C(=O)O 0.832 0.739 0.367 0.619 0.921 0.754 0.987 0.931 0.59 0.919 0.634 Compound_712 Oc1ccc2c(c1)oc(=O)c(c2c1ccc(c(c1)F)O)c1ccc(c(c1)F)O 0.871 0.709 0.955 0.703 0.992 0.96 0.995 0.974 0.829 0.46 0.833 Compound_713 OC(=O)CCc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.673 0.677 0.145 0.341 0.914 0.819 0.106 0.195 0.553 0.003 0.311 Compound_714 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnn[nH]1)c1ccc(cc1)O 0.885 0.722 0.849 0.667 0.771 0.685 0.428 0.607 0.947 0.331 0.812 Compound_715 Oc1ccc(cc1)c1c(c2ccc(cc2)O)c(=O)oc2c1ccc(c2)O 0.497 0.813 0.974 0.813 0.995 0.994 0.994 0.979 0.587 0.329 0.912 Compound_716 CCCC(c1ccc(c(c1)O)O)(c1ccc(c(c1)C)OCCN(C)C)CCC 0.631 0.487 0.037 0.381 0.724 0.679 0.062 0.59 0.175 0.011 0.415 Compound_717 Oc1cccc(c1)c1ccc2c(c1)ccc(c2)O 0.953 0.847 0.966 0.79 0.983 0.99 0.982 0.992 0.548 0.918 0.949 Compound_718 O=Cc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.934 0.621 0.708 0.728 0.961 0.992 0.996 0.993 0.751 0.955 0.94 Compound_719 C=CCN(S(=O)(=O)c1ccc(cc1)O)c1ccccc1 0.505 0.451 0.556 0.654 0.451 0.55 0.131 0.913 0.07 0.053 0.274 Compound_720 CCc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.874 0.579 0.796 0.672 0.974 0.966 0.937 0.985 0.841 0.995 0.911 Compound_721 CCC(=C(c1ccc2c(c1)scn2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.736 0.763 0.449 0.456 0.676 0.905 1.0 0.64 0.813 0.492 0.713 Compound_722 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1cccc(c1)O 0.716 0.712 0.494 0.703 0.954 0.958 0.621 0.714 0.418 0.528 0.295 Compound_723 Oc1ccc(cc1)S(=O)(=O)N(c1ccccc1)Cc1ccccc1 0.585 0.4 0.5 0.527 0.772 0.79 0.151 0.147 0.115 0.037 0.215 Compound_724 C#Cc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.936 0.615 0.896 0.672 0.953 0.913 0.982 0.993 0.819 0.991 0.932 Compound_725 COc1cccc(c1)OS(=O)(=O)C1CC2OC1C(=C2c1ccc(cc1)O)c1ccc(cc1)C=Cc1cc(OC)cc(c1)OC 0.688 0.709 0.427 0.723 0.946 0.943 0.753 0.473 0.412 0.881 0.313 Compound_726 COc1cc(C=Cc2cccc(c2)OS(=O)(=O)C2CC3OC2C(=C3c2ccc(cc2)O)c2ccc(cc2)O)cc(c1)OC 0.672 0.715 0.427 0.723 0.949 0.916 0.712 0.473 0.41 0.758 0.295 Compound_727 CCCN(S(=O)(=O)c1ccc(c(c1)C)O)c1ccccc1c1ccccc1 0.538 0.509 0.62 0.709 0.534 0.799 0.397 0.605 0.218 0.014 0.196 Compound_728 C=Cc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.967 0.62 0.847 0.687 0.98 0.974 0.982 0.997 0.85 0.987 0.87 Compound_729 c1ccc(cc1)Cn1c(cc2c1cccc2)c1nc2c([nH]1)cccc2 0.337 0.601 0.993 0.537 0.544 0.799 0.989 0.519 0.542 0.577 0.515 Compound_730 CCC(=C(c1ccc2n(c1)cnc2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.489 0.719 0.051 0.355 0.678 0.894 0.993 0.409 0.363 0.134 0.708 Compound_731 OC(=O)C=Cc1ccc(cc1)C1(C)c2ccc(cc2CCN1c1ccc(cc1F)C(C)C)O 0.753 0.668 0.339 0.454 0.979 0.945 0.807 0.835 0.661 0.198 0.316 Compound_732 ClCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN)c1ccccc1 0.321 0.497 0.116 0.615 0.989 0.99 0.029 0.092 0.462 0.032 0.684 Compound_733 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2Br)O 0.979 0.714 0.949 0.776 0.677 0.762 0.989 0.992 0.848 0.997 0.998 Compound_734 CCCC(c1cc(C)c(c(c1)O)O)(c1ccc(c(c1)C)O)CCC 0.954 0.711 0.729 0.578 0.923 0.771 0.107 0.991 0.612 0.994 0.944 Compound_735 CCN(S(=O)(=O)c1ccc(cc1)O)c1ccc(cc1)O 0.376 0.41 0.326 0.519 0.549 0.57 0.075 0.134 0.14 0.126 0.211 Compound_736 NCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)N 0.414 0.546 0.425 0.554 0.963 0.996 0.095 0.243 0.431 0.234 0.742 Compound_737 NCCOc1ccc(cc1)C(=C(CC)CC)c1ccc(cc1)O 0.413 0.518 0.084 0.602 0.756 0.957 0.047 0.193 0.239 0.014 0.296 Compound_738 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2C)O 0.861 0.811 0.923 0.779 0.956 0.991 0.557 0.996 0.761 0.992 0.939 Compound_739 NCCOc1ccc(cc1)C(=C(c1ccccc1)Cn1cncn1)c1ccc(cc1)O 0.37 0.69 0.359 0.7 0.46 0.901 0.784 0.165 0.351 0.01 0.4 Compound_740 Oc1ccc2c(c1)nc1c(c2c2ccccc2)cc2c(c1)cccc2 0.919 0.818 0.967 0.863 1.0 0.865 0.991 0.981 0.84 0.969 0.955 Compound_741 N#Cc1cc(cc2c1c(Cl)c(cc2)O)c1ccc(c(c1)F)O 0.97 0.629 0.912 0.68 0.98 0.681 0.895 0.994 0.796 0.91 0.997 Compound_742 Oc1ccc(cc1)CCC(=O)c1c(O)cc(cc1O)O 0.914 0.648 0.445 0.653 0.909 0.981 0.99 0.88 0.596 0.765 0.301 Compound_743 Oc1ccc(c(c1)Cl)C1N(C)C=NC1c1ccc(cc1Cl)O 0.29 0.607 0.285 0.581 0.668 0.743 0.011 0.142 0.226 0.709 0.8 Compound_744 COc1ccc(cc1)c1c(C)c2c(n1Cc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.404 0.706 0.786 0.893 0.967 0.965 0.925 0.509 0.346 0.052 0.816 Compound_745 CCC(=C(c1ccc(cc1)n1cncc1)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.385 0.689 0.039 0.374 0.869 0.912 0.995 0.124 0.686 0.259 0.805 Compound_746 Brc1cnc2c(c1)nc([nH]2)c1cc2c(n1Cc1ccccc1)cccc2 0.393 0.634 0.94 0.527 0.63 0.678 0.982 0.696 0.643 0.379 0.146 Compound_747 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)C(C)(C)C 0.742 0.691 0.223 0.467 0.983 0.974 0.712 0.922 0.682 0.195 0.372 Compound_748 CCCN(S(=O)(=O)c1ccc(cc1)O)c1ccccc1 0.542 0.477 0.403 0.499 0.457 0.541 0.09 0.219 0.155 0.018 0.17 Compound_749 CCn1nc(c2c1cc(O)cc2)c1ccc(cc1O)O 0.689 0.659 0.977 0.746 0.917 0.663 0.254 0.984 0.761 0.107 0.846 Compound_750 N#Cc1cc(cc2c1c(F)c(cc2)O)c1ccc(c(c1)F)O 0.961 0.601 0.912 0.68 0.994 0.814 0.98 0.994 0.812 0.898 0.987 Compound_751 OC(=O)C=C(c1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O)C 0.887 0.774 0.631 0.557 0.921 0.756 0.986 0.954 0.814 0.942 0.749 Compound_752 CCCCN(S(=O)(=O)c1ccc(cc1)O)c1ccccc1 0.615 0.497 0.403 0.495 0.522 0.584 0.132 0.554 0.24 0.019 0.165 Compound_753 OCCC(C1=CCC2C1(C)CCC1C2CCc2c1ccc(c2)O)C 0.969 0.86 0.013 0.476 0.983 0.959 0.167 0.471 0.049 0.969 0.951 Compound_754 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(c(c1)C)O 0.89 0.72 0.885 0.655 0.904 0.768 0.95 0.926 0.711 0.934 0.61 Compound_755 CCN(S(=O)(=O)c1ccc(c(c1)C)O)c1ccccc1 0.449 0.483 0.455 0.512 0.236 0.708 0.298 0.211 0.102 0.093 0.258 Compound_756 Oc1ccc(cc1)CC(c1ccc(cn1)O)C 0.258 0.699 0.605 0.528 0.296 0.663 0.009 0.621 0.378 0.157 0.651 Compound_757 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2(O)c1ccc2c(c1)CC(C2)(C(=O)C)C(=O)C)C 0.845 0.905 0.009 0.387 0.992 0.963 0.493 0.222 0.352 0.792 0.97 Compound_758 COc1ccc2c(c1)CC(C1C2CCC2(C1CCC2O)C)Sc1ccc(cc1)OCCN1CCCCC1 0.483 0.721 0.009 0.42 0.835 0.801 0.061 0.774 0.23 0.015 0.488 Compound_759 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)Br)O 0.866 0.589 0.103 0.652 0.689 0.705 0.222 0.905 0.41 0.681 0.94 Compound_760 CCC(=C(c1ccn2c(c1)cnn2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.429 0.715 0.023 0.321 0.69 0.786 0.99 0.486 0.662 0.136 0.648 Compound_761 CC#Cc1cc(cc2c1cc(O)cc2)c1ccc(c(c1)F)O 0.85 0.616 0.842 0.69 0.957 0.979 0.937 0.992 0.748 0.994 0.874 Compound_762 CCN(C(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O)CC 0.527 0.723 0.825 0.725 0.903 0.99 0.339 0.965 0.5 0.552 0.428 Compound_763 COc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.402 0.706 0.786 0.893 0.967 0.965 0.925 0.523 0.357 0.052 0.816 Compound_764 Clc1cccc(c1)N1CCN(CC1)C(=O)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.417 0.353 0.929 0.543 0.51 0.706 0.62 0.861 0.41 0.676 0.215 Compound_765 CCC(=C(c1ccn2c(c1)ccn2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.529 0.733 0.024 0.397 0.818 0.639 0.986 0.529 0.534 0.131 0.71 Compound_766 Oc1ccc(cc1Cl)c1ccc2c(c1)ccc(c2Cl)O 0.951 0.721 0.866 0.739 0.985 0.891 0.927 0.995 0.799 0.992 1.0 Compound_767 CCC(=C(c1ccc2c(c1)[nH]nc2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.614 0.777 0.217 0.439 0.917 0.718 0.999 0.316 0.67 0.591 0.894 Compound_768 Oc1ccc2c(c1)C=C(C12C(=O)c2c(C1=O)cccc2)c1cccc(c1)O 0.691 0.793 0.619 0.631 0.996 0.982 0.857 0.973 0.303 0.475 1.001 Compound_769 CNCCCCCCCCCCCCn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O 0.517 0.54 0.413 0.483 0.909 0.961 0.234 0.677 0.625 0.044 0.5 Compound_770 Oc1ccc(c(c1)Cl)C1N=CNC1c1ccc(cc1Cl)O 0.286 0.681 0.108 0.537 0.554 0.645 0.018 0.188 0.312 0.564 0.928 Compound_771 CCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN)c1ccccc1 0.423 0.531 0.123 0.548 0.955 0.989 0.04 0.322 0.328 0.015 0.196 Compound_772 Cc1cccc2c1nc([nH]2)c1cc2c(n1Cc1ccccc1)cccc2 0.23 0.638 0.994 0.542 0.5 0.784 0.996 0.879 0.518 0.446 0.419 Compound_773 CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)OCCCCCCCC)CCC 0.884 0.714 0.731 0.665 0.916 1.0 0.329 0.956 0.69 0.983 0.997 Compound_774 CC(=CCc1c(O)cc2c(c1O)C(=O)CC(O2)c1ccc(cc1)O)C 0.585 0.723 0.39 0.617 0.962 0.978 0.905 0.984 0.434 0.317 0.372 Compound_775 CCN(S(=O)(=O)c1ccc(cc1)O)c1ccccc1 0.492 0.431 0.357 0.504 0.41 0.499 0.063 0.12 0.088 0.096 0.201 Compound_776 N#Cc1cc(O)c(c2c1cc(cc2)c1ccc(c(c1)F)O)C 0.939 0.602 0.915 0.74 0.98 0.829 0.607 0.996 0.6 0.869 0.965 Compound_777 O=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.647 0.589 0.308 0.711 0.937 0.988 0.937 0.91 0.908 0.912 0.915 Compound_778 OCCn1nc(c2c1c(Cl)ccc2)c1ccc(cc1)O 0.505 0.745 0.917 0.734 0.825 0.648 0.102 0.862 0.63 0.055 0.812 Compound_779 Oc1ccc(cc1)S(=O)(=O)N(c1ccccc1)c1ccccc1 0.689 0.375 0.685 0.608 0.873 0.729 0.122 0.081 0.161 0.121 0.3 Compound_780 CCC1=C(c2ccc(cc2)O)C(c2c1ccc(c2)O)C(=O)Nc1ccc(cc1)O 0.607 0.841 0.676 0.459 0.977 0.932 0.58 0.581 0.566 0.948 0.904 Compound_781 COc1ccc2c(c1)OCCC(=C2c1ccc(cc1)OCC(=O)O)c1ccc(cc1)O 0.551 0.667 0.114 0.481 0.97 0.635 0.921 0.203 0.34 0.865 0.588 Compound_782 O=C(C1CCCN1C(=O)c1ccc(cc1)S(=O)(=O)N)OC1CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.624 0.726 -0.0 0.168 0.814 0.82 0.508 0.044 0.371 0.074 0.211 Compound_783 Oc1ccc2c(c1)c(C)c(n2CCCCn1c2ccc(cc2c(c1c1ccc(cc1)O)C)O)c1ccc(cc1)O 0.556 0.665 0.842 0.701 0.985 0.948 0.977 0.981 0.665 0.559 0.896 Compound_784 Oc1ccc2c(c1)sc(c2c1ccc(cc1)F)C(=O)c1ccc(cc1)S(=O)(=O)C 0.647 0.612 0.851 0.734 0.79 0.739 0.765 0.968 0.394 0.914 0.381 Compound_785 Oc1ccc(cc1)C(Cc1ccc(cn1)O)C 0.228 0.686 0.578 0.488 0.285 0.628 0.011 0.508 0.264 0.1 0.604 Compound_786 Oc1ccc(cc1)c1ccc2c(c1)cc(cc2)O 0.953 0.847 0.961 0.8 0.983 0.99 0.982 0.995 0.929 0.918 0.949 Compound_787 Oc1ccc2c(c1)n(nc2c1ccc(cc1O)O)C1CCCCC1 0.706 0.59 0.915 0.729 0.966 0.76 0.426 0.984 0.772 0.24 0.805 Compound_788 Cc1c2ccccc2n(c1c1ccccc1)Cc1ccc(cc1)OCCN1CCCCC1 0.387 0.64 0.484 0.768 0.91 0.961 0.983 0.184 0.243 0.775 0.733 Compound_789 CCC(=C(c1ccc(cc1)N)c1ccc(cc1)NCC(=O)N)c1ccc(cc1)N(=O)=O 0.737 0.576 0.057 0.275 0.865 0.842 0.244 0.086 0.526 0.724 0.375 Compound_790 CCC(=C(c1ccc2c(c1)nco2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.379 0.671 0.379 0.478 0.706 0.644 0.973 0.723 0.782 0.432 0.81 Compound_791 Oc1ccc(cc1)S(=O)(=O)N1C(C)CCc2c1cccc2 0.601 0.53 0.473 0.513 0.523 0.641 0.044 0.134 0.269 0.077 0.211 Compound_792 COCC1CC2C(c3c1cc(O)cc3)CCC1(C2CCC1O)C 0.908 0.812 0.012 0.534 0.996 0.986 0.024 0.687 0.103 0.938 0.916 Compound_793 Oc1ccc(cc1)C1=C(c2ccc(cc2)C=Cc2cc(O)cc(c2)O)C2OC1CC2S(=O)(=O)Oc1ccccc1C(F)(F)F 0.733 0.734 0.558 0.656 0.961 0.939 0.738 0.934 0.43 0.651 0.337 Compound_794 CC[N+]1=CN(C(C1c1ccc(cc1Cl)O)c1ccc(cc1Cl)O)CC 0.235 0.628 0.515 0.702 0.683 0.756 0.001 0.655 0.151 0.846 0.792 Compound_795 CCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccccc1 0.854 0.749 0.331 0.582 0.993 0.997 0.261 0.991 0.905 0.953 0.939 Compound_796 OC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1cccc(c1)F 0.705 0.642 0.491 0.393 0.962 0.893 0.34 0.77 0.704 0.014 0.481 Compound_797 Fc1cc(cc(c1O)F)c1ccc2c(c1)ccc(c2Cl)O 0.966 0.637 0.895 0.739 0.983 0.826 0.953 0.995 0.724 0.992 0.993 Compound_798 COc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCCC1)c1ccc(cc1)OC 0.373 0.736 0.643 0.829 0.965 0.93 0.979 0.118 0.42 0.374 0.864 Compound_799 C=Cc1cc(O)cc2c1cc(cc2)c1ccc(c(c1)F)O 0.974 0.62 0.89 0.704 0.98 0.974 0.982 0.998 0.77 0.987 0.87 Compound_800 BrC1=CN2C(N=C1)N=C(N2)c1cc2c(n1Cc1ccccc1)cccc2 0.62 0.714 0.999 0.576 0.619 0.788 0.622 0.965 0.49 0.035 0.231 Compound_801 N#Cc1cc(cc2c1cc(O)cc2)c1cc(F)c(c(c1)F)O 0.969 0.601 0.945 0.668 0.994 0.814 0.98 0.993 0.677 0.898 0.987 Compound_802 N#CC(=C(c1ccc(cc1)OCCN1CCOCC1)c1ccc(cc1)OCCN1CCOCC1)c1ccccc1 0.352 0.651 0.085 0.631 0.954 0.781 0.357 0.817 0.287 0.951 0.697 Compound_803 COc1c(OC)cc(cc1OC)C(=Cc1ccc(c(c1)O)OC)C(=O)N(CCCCCCCCCCCCn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C)C 0.55 0.862 0.581 0.703 0.946 0.885 0.991 0.98 0.45 0.803 0.647 Compound_804 COc1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)OC 0.343 0.76 0.643 0.829 0.946 0.968 0.964 0.118 0.372 0.3 0.853 Compound_805 CCCC(c1c[nH]c2c1ccc(c2)OCc1ccccc1)(c1ccc(c(c1)C)O)CCC 0.55 0.707 0.604 0.626 0.917 0.73 0.941 0.911 0.621 0.909 0.997 Compound_806 Oc1ccc(c(c1)F)C1N=CNC1c1c(Cl)cc(cc1Cl)O 0.382 0.646 0.254 0.519 0.672 0.691 0.022 0.176 0.408 0.564 0.907 Compound_807 Oc1ccc(c(c1)O)c1nn(c2c1ccc(c2)O)C 0.755 0.788 0.945 0.731 0.928 0.678 0.455 0.972 0.806 0.758 0.888 Compound_808 OC(=O)COc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O 0.547 0.493 0.213 0.493 0.939 0.831 0.85 0.253 0.374 0.963 0.726 Compound_809 Oc1ccc(cc1)C1=C(c2ccc(cc2)O)C2OC1C(C2)S(=O)(=O)Oc1cccc(c1)C=Cc1cc(O)cc(c1)O 0.696 0.712 0.528 0.692 0.956 0.949 0.571 0.794 0.426 0.528 0.295 Compound_810 Oc1ccc(cc1)c1ccc2c(c1)cccc2 0.952 0.845 0.961 0.827 0.972 0.995 0.981 0.991 0.983 0.976 0.909 Compound_811 COc1ccc(cc1)c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.874 0.756 0.779 0.643 0.922 0.76 0.995 0.894 0.856 0.838 0.566 Compound_812 NCCOc1ccc(cc1)C(=C(c1ccccc1)c1ccccc1)c1ccc(cc1)O 0.292 0.52 0.32 0.595 0.985 0.987 0.62 0.03 0.253 0.009 0.293 Compound_813 CCC(c1ccc(c(c1)O)O)(c1ccc(c(c1)C)O)CC 0.93 0.582 0.729 0.636 0.923 0.771 0.107 0.992 0.241 0.985 0.941 Compound_814 NCCOc1ccc(cc1)C(=C(c1ccccc1)C)c1ccc(cc1)O 0.383 0.525 0.226 0.566 0.955 0.989 0.04 0.063 0.286 0.012 0.154 Compound_815 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2N(=O)=O)O 0.96 0.791 0.982 0.806 0.978 0.915 0.992 0.999 0.699 0.997 0.981 Compound_816 Cc1ccc(cc1)C(=O)c1sc2c(c1c1ccc(cc1)F)ccc(c2)O 0.65 0.632 0.946 0.746 0.898 0.813 0.975 0.981 0.533 0.954 0.37 Compound_817 OCC12COC(C(C2)C(=CC1)C)c1cc(C)c(c(c1)C)O 0.881 0.595 0.052 0.601 0.773 0.983 0.129 0.846 0.619 0.838 0.927 Compound_818 Oc1ccc(cc1)c1c(Sc2ccc(cc2)OCCN2CCCCC2)oc2c(c1=O)ccc(c2)O 0.621 0.71 0.718 0.621 0.905 0.742 0.508 0.932 0.314 0.893 0.822 Compound_819 O=C1CCCC2C1(C)CCC1C2CCc2c1cc(Cl)c(c2)O 0.959 0.697 0.102 0.506 0.978 0.848 0.511 0.477 0.125 0.999 0.98 Compound_820 Oc1ccc(c(c1)Cl)C1[N+](=CN(C1c1ccc(cc1Cl)O)C)C 0.267 0.599 0.233 0.624 0.705 0.768 0.001 0.619 0.226 0.739 0.862 Compound_821 Oc1ccc(cc1)C=Cc1cc(O)cc(c1)O 0.916 0.856 0.854 0.721 0.905 0.898 0.991 0.987 0.95 0.215 0.794 Compound_822 Oc1ccc(cc1)c1cccc(c1)c1ccc(cc1)O 0.952 0.806 0.933 0.853 0.984 0.996 0.978 0.944 0.915 0.536 0.85 Compound_823 ONC(=O)CCCCOc1ccc(cc1)C(=C(c1ccc(cc1)OCCN(C)C)c1ccc(cc1)O)CC 0.258 0.53 0.007 0.761 0.839 0.991 0.088 0.086 0.338 0.289 0.384 Compound_824 C=CC12CCC(=CC1=CCC1C2CCC2(C1CCC2O)C)Cl 0.928 0.99 0.046 0.795 0.982 0.939 0.105 0.995 0.264 0.994 0.713 Compound_825 ONC(=O)CCCCc1ccc(cc1)C(=C(c1ccc(cc1)OCCN(C)C)c1ccc(cc1)O)CC 0.386 0.53 0.007 0.73 0.826 0.995 0.365 0.201 0.349 0.289 0.384 Compound_826 CCN(S(=O)(=O)c1ccc(cc1)O)c1ccccc1OC 0.403 0.503 0.446 0.624 0.282 0.433 0.109 0.035 0.189 0.24 0.281 Compound_827 COc1cccc(c1)N(S(=O)(=O)c1ccc(cc1)O)CC 0.411 0.433 0.427 0.588 0.453 0.532 0.177 0.083 0.108 0.1 0.25 Compound_828 O=C(N1CCN(CC1)c1cccc(c1)N(=O)=O)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.426 0.42 0.884 0.505 0.302 0.539 0.053 0.648 0.411 0.782 0.298 Compound_829 Oc1ccc(cc1)S(=O)(=O)N(c1ccccc1)C(C)C 0.497 0.355 0.437 0.505 0.454 0.556 0.063 0.051 0.135 0.158 0.309 Compound_830 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC)c1ccccc1 0.578 0.552 0.083 0.69 0.944 0.988 0.008 0.82 0.053 0.056 0.133 Compound_831 N#Cc1c(O)cc(c2c1ccc(c2)c1ccc(c(c1)F)O)C#N 0.975 0.653 0.953 0.751 0.982 0.837 0.837 0.998 0.601 0.903 0.991 Compound_832 COc1c(O)ccc2c1ccc(c2)c1ccc(cc1)O 0.926 0.736 0.922 0.792 0.903 0.752 0.451 0.994 0.846 0.932 0.939 Compound_833 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=C(C(=O)O)C)c1ccc(cc1)O 0.863 0.774 0.831 0.629 0.922 0.756 0.987 0.919 0.703 0.942 0.749 Compound_834 Oc1ccc2c(c1)CCN(S2(=O)=O)c1ccccc1Cl 0.647 0.487 0.842 0.658 0.597 0.614 0.037 0.758 0.181 0.09 0.4 Compound_835 c1ccc(cc1)c1c2cc3ccccc3cc2nc2c1cccc2 0.975 0.643 0.98 0.866 0.975 0.726 0.995 0.794 0.712 0.944 0.933 Compound_836 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)C(F)(F)F 0.906 0.657 0.835 0.639 0.937 0.751 0.968 0.95 0.664 0.955 0.848 Compound_837 CCC(=C(c1ccc2c(c1)nc[nH]2)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.46 0.749 0.474 0.412 0.622 0.79 0.994 0.441 0.343 0.344 0.941 Compound_838 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCCN(C)C)c1ccccc1 0.396 0.451 0.011 0.625 0.94 0.995 0.009 0.58 0.123 0.006 0.092 Compound_839 CCN(CCNC(=O)C=Cc1ccc(cc1)C1=C(CCOc2c1ccc(c2)F)c1ccc(cc1)O)CC 0.505 0.635 0.183 0.515 0.823 0.98 0.453 0.726 0.482 0.061 0.353 Compound_840 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1n[nH]nn1)c1ccc(cc1)F 0.708 0.686 0.488 0.571 0.793 0.832 0.599 0.608 0.795 0.012 0.617 Compound_841 OC(=O)C=Cc1ccc(c(c1)C)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.855 0.72 0.925 0.57 0.899 0.768 0.954 0.924 0.811 0.934 0.61 Compound_842 CCCC(c1ccc(n1C)C(=O)OCC)(c1ccc(c(c1)C)O)CCC 0.604 0.675 0.546 0.577 0.575 0.826 0.694 0.269 0.412 0.054 0.804 Compound_843 NCCOc1ccc(cc1)C(=Cc1ccccc1)c1ccc(cc1)O 0.404 0.52 0.434 0.62 0.965 0.993 0.114 0.153 0.253 0.009 0.293 Compound_844 CCC(=C(c1ccc(cc1)NS(=O)(=O)C)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.627 0.652 0.333 0.48 0.956 0.995 0.999 0.643 0.465 0.771 0.636 Compound_845 Oc1cccc2c1nc1cc3ccccc3cc1c2c1ccccc1 0.899 0.803 0.946 0.853 0.921 0.75 0.995 0.995 0.763 0.989 0.948 Compound_846 COc1cc(ccc1O)C1Nc2ccccc2C(=O)N1Cc1ccccc1 0.534 0.612 0.802 0.595 0.643 0.609 0.037 0.596 0.397 0.013 0.242 Compound_847 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(C)C)c1ccc(cc1)C(=O)NO 0.649 0.593 0.02 0.79 0.858 0.996 0.529 0.122 0.089 0.417 0.272 Compound_848 CCC(=C(c1ccc2c(c1)cn[nH]2)c1csc(c1)C=CC(=O)O)c1ccccc1 0.679 0.82 0.665 0.426 0.816 0.699 1.0 0.589 0.668 0.695 0.707 Compound_849 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCN(CC1)CC)c1ccccc1 0.635 0.546 0.192 0.418 0.975 0.987 0.007 0.518 0.431 0.043 0.664 Compound_850 FC(CNC(=O)C=Cc1ccc(cc1)C1(C)N(CCc2c1ccc(c2)O)c1ccc(cc1)F)F 0.679 0.565 0.401 0.44 0.91 0.834 0.163 0.869 0.62 0.014 0.357 Compound_851 Oc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)O 0.952 0.806 0.924 0.853 0.988 0.996 0.995 0.974 0.95 0.536 0.85 Compound_852 Oc1ccc(cc1)c1ccc2c(c1)ccc(c2c1ccccc1)O 0.953 0.826 0.961 0.822 0.99 0.992 0.446 0.991 0.926 0.957 0.946 Compound_853 Oc1ccc(c(c1)Cl)c1c(=O)oc2c(c1C)ccc(c2)O 0.839 0.657 0.91 0.595 0.987 0.847 0.971 0.963 0.899 0.602 0.903 Compound_854 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCN(CC1)C(C)C)c1ccccc1 0.635 0.533 0.318 0.402 0.972 0.986 0.005 0.174 0.424 0.022 0.491 Compound_855 OC(=O)C=Cc1ccc(cc1C)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.864 0.72 0.878 0.609 0.924 0.73 0.985 0.904 0.786 0.934 0.61 Compound_856 Oc1ccc2c(c1)ccc(c2)c1ccccc1 0.953 0.845 0.966 0.8 0.973 0.989 0.982 0.992 0.773 0.976 0.909 Compound_857 Oc1ccc(cc1)S(=O)(=O)N(c1ccccc1)CC(C)(C)C 0.64 0.486 0.587 0.482 0.534 0.644 0.059 0.128 0.222 0.346 0.26 Compound_858 OC(=O)C=Cc1ccc(cc1)Cc1c(c(=O)oc2c1ccc(c2)N)c1ccc(cc1C)F 0.562 0.614 0.944 0.428 0.996 0.763 0.999 0.563 0.599 0.556 0.758 Compound_859 COc1cc(O)c(c2c1C(=O)CC(O2)c1ccc(cc1)O)CC=C(C)C 0.549 0.796 0.604 0.681 0.962 0.978 0.905 0.975 0.46 0.267 0.966 Compound_860 N#Cc1c(O)ccc2c1ccc(c2)c1ccc(cc1)O 0.958 0.807 0.963 0.804 0.985 0.886 0.812 0.996 0.704 0.846 0.992 Compound_861 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1nnnn1C)c1ccc(cc1)F 0.795 0.691 0.24 0.572 0.708 0.816 0.627 0.591 0.75 0.005 0.518 Compound_862 Oc1cccc(c1)c1ccc2c(c1)cccc2O 0.953 0.847 0.961 0.834 0.936 0.945 0.954 0.991 0.612 0.918 0.949 Compound_863 CN(CCOc1ccc(c(c1)Cl)C1N=CNC1c1ccc(cc1Cl)O)C 0.37 0.504 0.017 0.582 0.549 0.655 0.005 0.18 0.125 0.072 0.371 Compound_864 Oc1ccc(c(c1)Cl)C(C(c1ccc(cc1Cl)O)N)N 0.326 0.648 0.504 0.583 0.819 0.735 0.019 0.473 0.403 0.84 0.983 Compound_865 COc1cc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c(cc1OC)NC(=O)c1cccs1 0.605 0.618 0.873 0.488 0.632 0.648 0.134 0.215 0.407 0.083 0.242 Compound_866 COc1ccc(c(c1)O)CCCc1ccc(cc1)O 0.706 0.604 0.556 0.735 0.94 0.856 0.462 0.276 0.655 0.237 0.276 Compound_867 Oc1cccc(c1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.432 0.418 0.766 0.525 0.564 0.415 0.05 0.433 0.409 0.201 0.137 Compound_868 Oc1ccc(cc1)c1nc(Oc2ccc(cc2)OCCN2CCCC2)c(c(n1)Cl)c1ccccc1 0.659 0.582 0.867 0.564 0.95 0.82 0.869 0.967 0.415 0.269 0.342 Compound_869 Clc1ccc2c(c1)nc1c(c2c2ccccc2)cc2c(c1)cccc2 0.966 0.59 0.958 0.749 0.98 0.726 0.996 0.491 0.889 0.932 0.766 Compound_870 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCN(CC1)C1CCC1)c1ccccc1 0.516 0.462 0.286 0.406 0.99 0.711 0.011 0.296 0.413 0.027 0.431 Compound_871 COc1cc(O)c(c2c1C(=O)CC(O2)c1ccc(cc1O)O)CC(C(=C)C)CC=C(C)C 0.484 0.736 0.504 0.643 0.964 0.979 0.964 0.988 0.454 0.256 0.688 Compound_872 Clc1c2nc3ccccc3c(c2cc2c1cccc2)c1ccccc1 0.974 0.59 0.981 0.78 0.962 0.673 0.995 0.833 0.744 0.932 0.766 Compound_873 CN(CCOc1ccc(cc1)C(=C(c1ccccc1)CCC(F)F)c1ccc(cc1)O)C 0.556 0.303 0.009 0.825 0.989 0.971 0.229 0.859 0.322 0.02 0.17 Compound_874 COC(=O)Cc1ccc(cc1)OCc1oc(nc1C)c1cccc(c1)OC 0.221 0.72 0.923 0.786 0.591 0.584 0.978 0.942 0.322 0.153 0.92 Compound_875 CCC(=C(c1ccccc1)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.237 0.338 0.004 0.9 0.867 0.977 0.004 0.116 0.322 0.021 0.126 Compound_876 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCN(CC1)C)c1ccccc1 0.658 0.501 0.117 0.485 0.975 0.987 0.007 0.158 0.436 0.018 0.344 Compound_877 Oc1ccc(c(c1)Cl)C1N=CNC1c1ccc(cc1Cl)OCCN1CCCCC1 0.41 0.519 0.062 0.574 0.566 0.649 0.005 0.21 0.227 0.361 0.392 Compound_878 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)N 0.85 0.74 0.594 0.58 0.997 1.0 0.969 0.924 0.881 0.6 0.987 Compound_879 Oc1ccc(cc1)Oc1oc2cc(O)ccc2c(=O)c1c1ccc(cc1)O 0.799 0.863 0.988 0.886 0.972 0.992 0.998 0.988 0.83 0.247 0.943 Compound_880 COc1ccc(cc1)c1cc2cc(OC)ccc2nc1Nc1ccc(cc1)NC(=O)CN1CCN(CC1)C 0.443 0.607 0.969 0.565 0.871 0.875 0.677 0.64 0.531 0.506 0.532 Compound_881 Oc1ccc(c(c1)I)C1N=CNC1c1ccc(cc1I)O 0.162 0.617 0.108 0.537 0.415 0.362 0.009 0.188 0.279 0.503 0.733 Compound_882 Oc1ccc(c(c1)Cl)C1N=CNC1c1ccc(cc1Cl)OCCN1CCCC1 0.395 0.529 0.062 0.594 0.617 0.684 0.008 0.192 0.227 0.713 0.545 Compound_883 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)F 0.918 0.628 0.912 0.59 0.917 0.745 0.977 0.915 0.854 0.907 0.665 Compound_884 Oc1ccc(cc1)Sc1oc2cc(O)ccc2c(=O)c1c1ccc(cc1)O 0.688 0.877 0.988 0.886 0.928 0.937 0.988 0.988 0.491 0.118 0.975 Compound_885 Oc1ccc(cc1)C=CC(=O)c1ccc(cc1O)O 0.975 0.777 0.924 0.791 0.913 0.98 0.99 0.938 0.634 0.947 0.799 Compound_886 NCCCc1ccc(cc1)C(=C(c1ccc(cc1)O)CC)c1ccc(cc1)O 0.487 0.521 0.06 0.409 0.904 0.995 0.032 0.099 0.432 0.006 0.219 Compound_887 ONC(=O)CCc1ccc(cc1)C(=C(c1ccc(cc1)OCCN(C)C)c1ccc(cc1)O)CC 0.351 0.538 0.007 0.764 0.826 0.995 0.365 0.201 0.313 0.213 0.331 Compound_888 OCCCC(=C(c1cccc(c1)O)c1ccc(cc1)N1CCN(CC1)C(C)C)c1ccccc1 0.559 0.533 0.419 0.392 0.953 0.902 0.015 0.283 0.39 0.022 0.491 Compound_889 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)OC)O 0.838 0.667 0.135 0.683 0.888 0.252 0.387 0.931 0.351 0.125 0.891 Compound_890 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCN(CC1)C1CCCCC1)c1ccccc1 0.496 0.499 0.286 0.406 0.993 0.99 0.018 0.296 0.43 0.027 0.412 Compound_891 Clc1cc(Cl)c(c(c1O)Cc1c(O)c(Cl)cc(c1Cl)Cl)Cl 0.686 0.536 0.371 0.665 0.918 0.853 0.875 0.999 0.836 0.969 0.935 Compound_892 COc1ccc(cc1)c1nc(Oc2ccc(cc2)OCCN2CCCC2)c(c(n1)Cl)c1ccccc1 0.647 0.611 0.635 0.496 0.919 0.804 0.974 0.676 0.447 0.05 0.287 Compound_893 Oc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.575 0.751 0.694 0.597 0.958 0.814 0.586 0.896 0.445 0.806 0.217 Compound_894 COCC1CC2C3CCC(C3CCC2c2c1cc(O)cc2)O 0.908 0.562 0.02 0.509 0.992 0.966 0.133 0.414 0.15 0.893 0.638 Compound_895 O=C(N1CCN(CC1)c1ccc(cc1)C(F)(F)F)CCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.418 0.382 0.881 0.559 0.51 0.517 0.475 0.796 0.463 0.347 0.247 Compound_896 COc1ccc2c(c1)nc(c(c2)c1ccc(cc1)OC)Nc1ccc(cc1)NC(=O)CN1CCN(CC1)C 0.339 0.617 0.97 0.547 0.884 0.816 0.786 0.759 0.531 0.69 0.561 Compound_897 COc1cc2c(cc1OC)[nH]c(=S)n(c2=O)CCCC(=O)N1CCN(CC1)c1cccc(c1)Cl 0.434 0.528 0.886 0.528 0.426 0.716 0.538 0.616 0.431 0.49 0.187 Compound_898 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)O)O 0.861 0.557 0.148 0.628 0.951 0.408 0.26 0.926 0.155 0.286 0.678 Compound_899 COc1ccccc1C(C(C(=O)N1CCC(CC1)c1cccc(c1)C(F)(F)F)(C#N)C)c1cccc2c1cccc2 0.393 0.667 0.592 0.596 0.857 0.745 0.908 0.923 0.437 0.01 0.763 Compound_900 O=C1NN(C(=O)C1Cc1c[nH]c2c1cccc2)c1ccc(c(c1)Cl)Cl 0.428 0.632 0.992 0.34 0.554 0.669 0.952 0.935 0.416 0.643 0.747 Compound_901 COc1ccc(c(c1)OC)N1C(=O)c2c(C1=O)cc(cc2)O 0.71 0.781 0.838 0.714 0.865 0.724 0.99 0.281 0.598 0.6 0.547 Compound_902 OCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)N1CCNCC1)c1ccccc1 0.505 0.457 0.005 0.24 0.958 0.929 0.004 0.218 0.253 0.034 0.383 Compound_903 O=Cc1c(O)c(O)c(c2c1c(O)c(c(c2)C)c1c(C)cc2c(c1O)c(C=O)c(c(c2C(C)C)O)O)C(C)C 0.85 0.746 0.279 0.664 0.933 0.867 0.062 0.994 0.95 0.265 0.87 Compound_904 Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)C=Cc1ncn(c1)C)c1ccc(cc1)F 0.707 0.72 0.506 0.648 0.811 0.835 0.824 0.56 0.795 0.005 0.691 Compound_905 O=C1CCC2C1(C)CCC1C2CCc2c1ccc(c2)OS(=O)(=O)N 0.406 0.745 0.081 0.294 0.841 0.989 0.045 0.05 0.068 0.221 0.53 Compound_906 Oc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.546 0.698 0.575 0.661 0.958 0.845 0.568 0.901 0.271 0.839 0.581 Compound_907 Oc1cccc(c1)c1ccc2c(c1)cc(cc2)O 0.953 0.847 0.966 0.79 0.983 0.99 0.982 0.992 0.586 0.918 0.949 Compound_908 FC(c1cccc2c1nc1cc3ccccc3cc1c2c1ccccc1)(F)F 0.927 0.594 0.933 0.806 0.988 0.649 0.994 0.939 0.745 0.879 0.916 Compound_909 Oc1ccc2c(c1)C(=O)N(C2=O)c1ccccc1 0.871 0.737 0.793 0.578 0.909 0.932 0.895 0.851 0.427 0.864 0.579 Compound_910 Clc1ccc(cc1)c1oc(c(c1)c1nn2c(s1)nnc2c1ccoc1C)C 0.493 0.677 0.854 0.636 0.648 0.653 0.972 0.915 0.511 0.32 0.438 Compound_911 COc1ccc(cc1)c1nc(Nc2ccc(cc2)NC(=O)CN2CCCC2)cc(n1)Cl 0.424 0.582 0.559 0.461 0.776 0.838 0.165 0.82 0.404 0.452 0.198 Compound_912 Oc1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)O 0.873 0.781 0.793 0.578 0.948 0.609 0.928 0.851 0.39 0.827 0.842 Compound_913 CC(CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)c1sc2c(c1)CCC2)C 0.544 0.588 0.735 0.466 0.176 0.631 0.823 0.18 0.415 0.724 0.216 Compound_914 CCOc1cc(Br)cc(c1O)CNNC(=O)c1ccc2c(c1)OCCO2 0.339 0.591 0.514 0.491 0.695 0.645 0.12 0.257 0.441 0.15 0.318 Compound_915 O=CNC(c1ccc(cc1Cl)O)C(c1ccc(cc1Cl)O)N 0.141 0.651 0.256 0.393 0.629 0.736 0.049 0.261 0.385 0.436 0.882 Compound_916 OC1C(=O)Nc2c(SC1c1ccccc1)cccc2 0.4 0.643 0.23 0.515 0.714 0.377 0.831 0.056 0.253 0.548 0.7 Compound_917 CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(C)cc(n1)O 0.528 0.512 0.999 0.587 0.65 0.63 0.415 0.06 0.345 0.066 0.56 Compound_918 CCOC(=O)COc1ccc(cc1)c1ccc(c(c1)Cc1ccc(cc1)c1ccccc1)OCCN(C)C 0.099 0.406 0.081 0.556 0.815 0.904 0.528 0.904 0.412 0.041 0.193 Compound_919 CCN(Cc1ccccn1)Cc1ccc(cc1)C(=O)N1CCc2c(C1)cc(cc2)OS(=O)(=O)N 0.117 0.705 0.312 0.26 0.258 0.935 0.815 0.227 0.335 0.034 0.584 Compound_920 CCN=c1ccc(cc(c1O)C(=O)C=Cc1ccccc1Cl)Br 0.731 0.607 0.98 0.663 0.552 0.549 0.932 0.698 0.723 0.402 0.754 Compound_921 NCCOc1ccc(cc1)C(=C1CCc2c1cccc2)c1ccc(cc1)O 0.354 0.585 0.344 0.527 0.979 0.992 0.144 0.101 0.264 0.015 0.568 Compound_922 CCOC(=O)COc1ccc(cc1Cc1ccc2c(c1)cccc2)c1ccc(cc1)OCCN(C)C 0.087 0.564 0.228 0.517 0.756 0.842 0.579 0.934 0.385 0.102 0.3 Compound_923 CCOC(=O)c1cc(CSc2nc3ccccc3c(=O)n2Cc2ccco2)c2c(c1)COCO2 0.585 0.668 0.999 0.574 0.232 0.686 0.92 0.174 0.392 0.865 0.673 Compound_924 COc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)O 0.837 0.798 0.812 0.651 0.826 0.925 0.984 0.176 0.73 0.631 0.52 Compound_925 CNCCOc1ccc(cc1)C(=C(c1ccccc1)CCCO)c1ccc(cc1)O 0.452 0.455 0.006 0.317 0.933 0.93 0.067 0.049 0.202 0.011 0.045 Compound_926 Oc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCN2CCCCC2)c(=O)c2c1ccc(c2)O 0.773 0.631 0.164 0.756 0.967 0.955 0.319 0.939 0.378 0.654 0.422 Compound_927 CCC12CC(O)C(CC1CCc1c2ccc(c1)O)(O)c1ccccc1 0.756 0.772 0.093 0.622 0.986 0.948 0.864 0.565 0.158 0.982 0.91 Compound_928 OC(=O)C=Cc1ccc(cc1)N(c1c(sc2c1ccc(c2)O)c1ccc(cc1)O)C 0.786 0.767 0.937 0.608 0.911 0.76 0.983 0.931 0.887 0.948 0.531 Compound_929 Oc1ccc2c(c1)cc(cc2)c1ccccc1 0.953 0.845 0.966 0.8 0.973 0.989 0.982 0.992 0.908 0.976 0.909 Compound_930 CN(CCOc1ccc(cc1)Nc1nc(nc(c1c1ccccc1)Cl)c1ccc(cc1)O)C 0.668 0.528 0.855 0.567 0.967 0.87 0.473 0.97 0.443 0.1 0.448 Compound_931 CN(CCOc1ccc(cc1)C1N=CNC1c1ccc(cc1)O)C 0.208 0.545 0.028 0.542 0.094 0.51 0.003 0.087 0.142 0.012 0.213 Compound_932 FC(c1ccc2c(c1)cc1c(c2)nc2c(c1c1ccccc1)cccc2)(F)F 0.964 0.594 0.968 0.802 0.988 0.649 0.994 0.924 0.653 0.879 0.916 Compound_933 N#CC1=C2SCN(CN2C(=O)CC1c1ccc(o1)C)c1cccc(c1)C 0.619 0.614 0.337 0.513 0.697 0.584 0.963 0.828 0.477 0.054 0.443 Compound_934 CCN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)O)CC 0.718 0.811 0.849 0.634 0.954 0.751 0.696 0.859 0.238 0.281 0.31 Compound_935 O=C(c1cnn2c1nc(cc2C(F)(F)F)c1ccco1)Nc1cnn(c1)C12CC3CC(C2)CC(C1)C3 0.513 0.746 0.064 0.713 0.67 0.658 0.995 0.965 0.376 0.068 0.489 Compound_936 CCOc1cccc2c1oc(=O)c(c2)c1cn2c(n1)ccc(c2)C 0.597 0.772 0.971 0.63 0.306 0.677 0.276 0.868 0.132 0.021 0.846 Compound_937 Oc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.668 0.721 0.844 0.585 0.952 0.805 0.679 0.928 0.323 0.838 0.751 Compound_938 CCCC(=NNc1ccc(cc1)Cl)c1cnnc(n1)c1ccccc1 0.607 0.69 0.872 0.717 0.527 0.818 0.207 0.965 0.665 0.008 0.118 Compound_939 Oc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.635 0.67 0.901 0.558 0.959 0.785 0.719 0.925 0.54 0.864 0.795 Compound_940 Clc1cc(Sc2cc(Cl)cc(c2O)Cl)c(c(c1)Cl)O 0.605 0.421 0.292 0.595 0.905 0.898 0.937 0.712 0.884 0.996 0.992 Compound_941 COC(=O)Cc1ccc(cc1)OCc1oc(nc1C)c1ccccc1OC 0.228 0.749 0.923 0.786 0.559 0.589 0.979 0.929 0.444 0.201 0.925 Compound_942 CC1(C)OCc2c(C1)c1c(s2)c2nnnn2c2n1nnn2 0.479 0.755 0.002 0.39 0.646 0.667 0.181 0.128 0.709 0.094 0.662 Compound_943 N#CC(=Cc1ccc(c(c1)N(=O)=O)N1CCCCC1)c1nc2c([nH]1)ccc(c2)C 0.457 0.697 0.904 0.638 0.657 0.676 0.454 0.968 0.468 0.039 0.791 Compound_944 Oc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)F 0.697 0.687 0.694 0.597 0.974 0.858 0.435 0.891 0.449 0.867 0.382 Compound_945 CCN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)O)CC 0.606 0.697 0.958 0.613 0.96 0.767 0.407 0.916 0.247 0.624 0.878 Compound_946 Oc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)F 0.684 0.708 0.901 0.558 0.969 0.815 0.447 0.925 0.523 0.899 0.547 Compound_947 O=C(Cc1ccc(s1)S(=O)(=O)N1CCOCC1)Nc1nc2c(s1)CCCC2 0.55 0.54 0.044 0.355 0.447 0.683 0.165 0.343 0.402 0.444 0.193 Compound_948 COc1cccc(c1)c1oc(c(n1)C)COc1ccc(cc1)C(=O)OC 0.268 0.72 0.964 0.753 0.638 0.581 0.975 0.798 0.552 0.153 0.92 Compound_949 CCN(CCOc1ccc(cc1)Nc1cc(Cl)nc(n1)c1ccc(cc1)OC)CC 0.606 0.611 0.939 0.54 0.912 0.87 0.199 0.936 0.169 0.16 0.601 Compound_950 CCc1ccc(cc1)Nc1nc(CSc2nnnn2c2ccccc2)nc(n1)N 0.722 0.591 0.638 0.546 0.644 0.851 0.944 0.74 0.822 0.024 0.654 Compound_951 O=C(Cc1coc2c1cc1CCCc1c2)OCc1cc(=O)n2c(n1)sc1c2cccc1 0.625 0.538 0.916 0.429 0.582 0.731 0.991 0.444 0.551 0.669 0.534 Compound_952 O=N(=O)c1nn(C)c(=O)c2c1c(c1nc3c(s1)cccc3)c(n2C1CCCCC1)N 0.673 0.609 0.834 0.637 0.543 0.729 0.11 0.8 0.707 0.007 0.249 Compound_953 Oc1ccc(c(c1)Cl)C1N=C(NC1c1c(Cl)cc(cc1Cl)O)C 0.314 0.633 0.157 0.505 0.649 0.634 0.045 0.101 0.414 0.49 0.634 Compound_954 O=C(N1CCN(CC1)c1ccccc1)CNc1ccc(cc1)C(=O)C 0.22 0.476 0.366 0.452 0.207 0.795 0.008 0.639 0.406 0.011 0.135 Compound_955 COc1cc(ccc1C=CC(=O)O)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.817 0.778 0.795 0.643 0.914 0.726 0.994 0.915 0.906 0.707 0.641 Compound_956 N#CCCSC1=C(C)SC(=C2SC(=C(S2)C)SCCC#N)S1 0.627 0.515 0.064 0.474 0.67 0.599 0.981 0.739 0.7 0.251 0.832 Compound_957 CCN(CCOc1ccc(cc1)Oc1cc(Cl)nc(n1)c1ccc(cc1)OC)CC 0.749 0.553 0.18 0.554 0.869 0.808 0.123 0.864 0.184 0.029 0.32 Compound_958 Oc1c(C=Nc2cccc3c2nccc3)sc2c1cccc2 0.538 0.798 0.911 0.611 0.685 0.701 0.754 0.947 0.53 0.831 0.847 Compound_959 COc1ccccc1N1CCN(CC1)C(=O)c1sc2c(c1)CCC2 0.418 0.643 0.113 0.421 0.319 0.7 0.106 0.131 0.427 0.175 0.133 Compound_960 COC(=O)c1cccc(c1)OCc1oc(nc1C)c1ccccc1OC 0.283 0.749 0.973 0.739 0.511 0.573 0.988 0.811 0.313 0.201 0.925 Compound_961 CC=C1C(O)CC2C1(C)CCC1C2CCc2c1ccc(c2)OC 0.91 0.9 0.017 0.624 0.968 0.989 0.02 0.978 0.089 0.989 0.992 Compound_962 O=C1CCC2(C(=C1C)c1ccc3c(c1C2)cn[nH]3)Cc1ccc2c(c1)cccc2 0.744 0.826 0.81 0.539 0.898 0.707 0.992 0.989 0.65 0.109 0.82 Compound_963 CCOC(=O)C1=C(O)C(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccccc2)N=C1C 0.561 0.581 0.926 0.628 0.164 0.272 0.02 0.585 0.342 0.281 0.671 Compound_964 COc1ccc(cc1)c1nc(Oc2ccc(cc2)OCCN(C)C)cc(n1)Cl 0.776 0.524 0.137 0.497 0.869 0.808 0.123 0.73 0.272 0.035 0.139 Compound_965 CCN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)O)c(=O)oc2c1ccc(c2)O)CC 0.584 0.775 0.924 0.649 0.953 0.787 0.362 0.922 0.095 0.61 0.86 Compound_966 COc1cc2c(cc1O)CCC1C2CCC2(C1CCCC2=O)C 0.939 0.732 0.068 0.437 0.919 0.647 0.732 0.208 0.096 0.855 0.864 Compound_967 COc1ccc(cc1)c1nc(Oc2ccc(cc2)OCCN2CCCC2)cc(n1)Cl 0.712 0.594 0.116 0.442 0.872 0.82 0.113 0.737 0.327 0.05 0.267 Compound_968 O=C(Cn1ncc2c1c1ccccc1oc2=O)Nc1nc2c(s1)cccc2 0.496 0.546 0.991 0.454 0.568 0.712 0.996 0.827 0.9 0.015 0.16 Compound_969 COc1cc(ccc1OC)c1nc(C(=O)N)c2c(n1)n(c1cccc(c1)Cl)c(n2)O 0.585 0.627 0.854 0.539 0.756 0.647 0.607 0.956 0.388 0.02 0.712 Compound_970 CCC(=C(c1ccc(nc1)O)c1ccc(cc1)C=CC(=O)O)c1ccccc1 0.741 0.686 0.095 0.356 0.775 0.499 0.383 0.527 0.363 0.169 0.624 Compound_971 O=C(c1ccc2c(c1)OCO2)Nc1ccc2c(c1)nn(n2)c1ccccc1 0.505 0.663 0.999 0.717 0.748 0.74 0.224 0.417 0.453 0.323 0.483 Compound_972 CC(NC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1cccc(c1)Cl)C 0.634 0.547 0.997 0.709 0.676 0.662 0.987 0.69 0.389 0.457 0.736 Compound_973 N#CC1=C(N)Oc2c(C1c1cccc(c1)OC(=O)N1CCOCC1)c(CC)n[nH]2 0.631 0.646 0.141 0.48 0.795 0.68 0.28 0.695 0.39 0.243 0.717 Compound_974 Oc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)O 0.659 0.721 0.844 0.585 0.962 0.834 0.401 0.93 0.378 0.879 0.757 Compound_975 CN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)O)C 0.726 0.656 0.551 0.6 0.979 0.827 0.478 0.872 0.44 0.058 0.179 Compound_976 Cc1ccc(cc1)c1nnc(n1N=CC=Cc1ccccc1N(=O)=O)S 0.652 0.538 0.96 0.755 0.568 0.687 0.916 0.999 0.539 0.877 0.878 Compound_977 CN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)O)C 0.696 0.654 0.831 0.588 0.972 0.754 0.718 0.926 0.581 0.405 0.676 Compound_978 Brc1ccc(cc1)c1nnc(c2c1noc2)c1cccnc1 0.467 0.631 0.98 0.735 0.647 0.649 0.978 0.326 0.691 0.378 0.735 Compound_979 COc1ccccc1n1c(SCC(=O)NC2CCCCC2)nc2c(c1=O)SCC2 0.495 0.483 0.065 0.369 0.418 0.515 0.289 0.251 0.381 0.013 0.211 Compound_980 COc1ccc(cc1)c1c(=O)oc2c(c1Nc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.668 0.744 0.865 0.554 0.943 0.77 0.493 0.889 0.405 0.568 0.87 Compound_981 O=C(c1ccc2c(c1)OCO2)Nc1cccc(c1)c1cn2c(n1)nccc2 0.544 0.691 0.997 0.719 0.522 0.698 0.911 0.579 0.333 0.13 0.735 Compound_982 CCN(CCOc1ccc(cc1)n1c2c3ccc(cc3C(=O)c2c2c(c1=O)cc(cc2)O)O)CC 0.704 0.666 0.283 0.764 0.8 0.592 0.403 0.954 0.153 0.12 0.576 Compound_983 COc1cccc(c1)C1CC(Nc2n1nc(n2)N)c1ccc(cc1)F 0.574 0.62 0.847 0.589 0.166 0.672 0.899 0.219 0.688 0.085 0.806 Compound_984 O=C1c2ccccc2C(=C1c1ccnc2c1cccc2)O 0.545 0.818 0.909 0.464 0.566 0.676 0.842 0.33 0.798 0.089 0.972 Compound_985 O=N(=O)c1cc(ccc1NN=Cc1c(C)nn(c1Cl)c1ccccc1)S(=O)(=O)Nc1ccccc1C(=O)O 0.468 0.508 0.118 0.397 0.711 0.64 0.919 0.965 0.412 0.772 0.663 Compound_986 Oc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)O 0.539 0.738 0.575 0.661 0.974 0.886 0.416 0.899 0.355 0.892 0.5 Compound_987 COc1ccc2c(c1)c1nnc(nc1[nH]2)SCc1nnc(o1)c1ccc(cc1)C 0.402 0.555 0.981 0.635 0.713 0.657 0.95 0.695 0.538 0.129 0.629 Compound_988 Cc1ccc(o1)c1nc2ccccc2c(c1)C(=O)NCc1ccco1 0.37 0.561 0.994 0.568 0.473 0.55 0.975 0.834 0.402 0.014 0.672 Compound_989 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.615 0.812 0.619 0.548 0.822 0.637 0.564 0.47 0.481 0.355 0.167 Compound_990 COc1ccc2c(c1)c(=O)oc1c2cc2c(c1)oc(c2C)C 0.288 0.719 0.968 0.593 0.591 0.786 0.996 0.24 0.595 0.358 0.922 Compound_991 O=C(c1cc(n(c1C)Cc1cccs1)C)CSc1nnc(o1)c1ccccc1F 0.516 0.574 0.962 0.692 0.719 0.655 0.965 0.882 0.468 0.076 0.456 Compound_992 Brc1ccc(o1)C(=O)Oc1ccc(cc1)c1cnc2c(n1)cccc2 0.333 0.622 0.71 0.687 0.5 0.669 0.957 0.744 0.578 0.304 0.918 Compound_993 O=C(Cc1cn2c(n1)scc2)OCc1nc2c(s1)cccc2 0.625 0.677 0.913 0.389 0.627 0.653 0.966 0.845 0.882 0.226 0.629 Compound_994 Fc1ccc(cc1)CNC(=O)c1cc2c(n(c1=N)Cc1cccnc1)nc1n(c2=O)cccc1 0.665 0.576 0.623 0.331 0.201 0.696 0.004 0.239 0.511 0.029 0.374 Compound_995 O=C(C(c1ccccc1)c1ccccc1)Nc1ccc(cc1)N1CCCC1 0.461 0.555 0.896 0.465 0.385 0.941 0.888 0.596 0.354 0.457 0.209 Compound_996 COC(=O)C(C(=O)OC)CC1(C)CC2CCC1CC2C(CCNC(=O)CCC(C)C)(C)C 0.239 0.392 0.097 0.264 0.099 0.453 0.511 0.272 0.338 0.009 0.127 Compound_997 O=S1C2C3C(C1C(=C2c1ccc(cc1)O)c1ccc(cc1)O)C(=O)N(C3=O)c1ccccc1 0.722 0.838 0.388 0.49 0.967 0.814 0.34 0.165 0.516 0.986 0.568 Compound_998 O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)CCC(=O)c1cccs1 0.544 0.491 0.831 0.503 0.477 0.679 0.674 0.73 0.417 0.08 0.092 Compound_999 Cc1ccc(cc1)c1csc(n1)NC(=O)c1ccno1 0.369 0.605 0.868 0.565 0.309 0.753 0.592 0.393 0.557 0.16 0.182 Compound_1000 Oc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCN2CCCC2)c(=O)c2c1ccc(c2)O 0.771 0.611 0.164 0.767 0.977 0.965 0.591 0.938 0.403 0.611 0.468 Compound_1001 O=C(Cn1c(=O)n(Cc2ccco2)c(=O)c2c1sc1c2CCCCC1)Nc1ccccc1 0.632 0.427 0.979 0.566 0.455 0.652 0.267 0.646 0.378 0.76 0.208 Compound_1002 CCSc1nnc(s1)NC(=O)C1Cc2ccccc2CN1C(=O)c1ccco1 0.486 0.577 0.33 0.361 0.403 0.656 0.493 0.159 0.381 0.033 0.198 Compound_1003 COc1ccc(cc1)c1nnc(o1)SCC(=O)c1cc(n(c1C)Cc1cccs1)C 0.479 0.691 0.973 0.696 0.727 0.658 0.915 0.896 0.475 0.11 0.55 Compound_1004 Cc1cc(ccc1n1c(C)ccc1C)C(=O)O 0.215 0.499 0.04 0.333 0.423 0.87 0.949 0.355 0.791 0.026 0.453 Compound_1005 CCOC(=O)C1=C(Nc2ccc(cc2)C)SC(=Cc2cn(c3c2cccc3)CC(=O)NCC2CCCO2)C1=O 0.754 0.599 0.391 0.481 0.721 0.583 0.798 0.692 0.419 0.851 0.647 Compound_1006 CN(CCOc1ccc(cc1)n1c2c3ccc(cc3C(=O)c2c2c(c1=O)cc(cc2)O)O)C 0.701 0.686 0.086 0.72 0.8 0.592 0.403 0.909 0.297 0.066 0.264 Compound_1007 OC(=O)C=Cc1ccc(cn1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.742 0.702 0.592 0.585 0.783 0.691 0.832 0.964 0.587 0.798 0.91 Compound_1008 O=C(N1C(C)Cc2c1cccc2)CSc1nnc(o1)c1ccc(cc1)S(=O)(=O)N1CCCC1 0.549 0.576 0.169 0.654 0.667 0.652 0.906 0.377 0.392 0.26 0.227 Compound_1009 Fc1ccc(cc1)c1c(=O)oc2c(c1Nc1ccc(cc1)OCCN1CCCCC1)cccc2 0.601 0.696 0.855 0.523 0.937 0.835 0.733 0.395 0.511 0.594 0.625 Compound_1010 COc1cccc2c1oc(=O)c(c2)c1cn2c(n1)cc(cc2)C 0.614 0.835 0.982 0.611 0.25 0.671 0.342 0.808 0.759 0.015 0.696 Compound_1011 COC(=O)C(=CC1(C)CC2C=CC1CC2C(CCNC(=O)CCC(C)C)(C)C)C(=O)OC 0.775 0.478 0.634 0.422 0.383 0.889 0.412 0.988 0.365 0.096 0.341 Compound_1012 COc1ccc(c2c1n(CC)c(=NC(=O)c1ccc(cc1)N1C(=O)CCC1=O)s2)OC 0.54 0.634 0.69 0.518 0.639 0.642 0.748 0.32 0.667 0.866 0.42 Compound_1013 CCc1ccc(cc1)NC(=O)c1noc2c1CCC2 0.383 0.625 0.806 0.661 0.668 0.628 0.801 0.511 0.955 0.481 0.692 Compound_1014 COc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.611 0.716 0.842 0.503 0.945 0.705 0.702 0.592 0.596 0.592 0.69 Compound_1015 CCCCOC(=O)c1ccc(c(c1)I)O 0.681 0.23 0.869 0.713 0.915 0.734 0.829 0.353 0.5 0.491 0.623 Compound_1016 CCOC(=O)CSc1nn(c(=S)s1)C 0.297 0.379 0.504 0.507 0.271 0.499 0.101 0.337 0.522 0.881 0.682 Compound_1017 CC(=O)Nc1ccc(cc1)N=Cc1nc(oc1O)c1ccc(cc1)C 0.387 0.722 0.979 0.689 0.605 0.629 0.862 0.906 0.625 0.105 0.5 Compound_1018 CCCCOC(=O)c1ccc(c(c1)Br)O 0.859 0.216 0.869 0.713 0.686 0.681 0.893 0.353 0.497 0.803 0.657 Compound_1019 CN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)O)c(=O)oc2c1ccc(c2)O)C 0.672 0.705 0.736 0.636 0.953 0.787 0.362 0.901 0.436 0.339 0.761 Compound_1020 CCc1ccc2c(c1)sc(n2)NC(=O)c1ccc2c(c1)nc(nc2O)CN1CCOCC1 0.645 0.493 0.897 0.428 0.68 0.659 0.986 0.756 0.543 0.476 0.423 Compound_1021 COc1cc(Cl)c(cc1NC(=O)COc1ccc(cc1)n1cnnn1)OC 0.416 0.643 0.68 0.548 0.587 0.672 0.874 0.032 0.412 0.405 0.472 Compound_1022 N#Cc1c(NC(=O)c2ccc(o2)Cn2ncc(c2)N(=O)=O)sc2c1CCC(C2)C 0.629 0.536 0.263 0.561 0.668 0.647 0.816 0.942 0.527 0.29 0.533 Compound_1023 CN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)O)c(=O)oc2c1ccc(c2)O)C 0.522 0.754 0.41 0.675 0.977 0.948 0.477 0.828 0.237 0.062 0.2 Compound_1024 Cc1ccc(cc1)C(=O)ONc1ccc(cc1)N=NC(=O)c1ccccc1O 0.632 0.793 0.94 0.713 0.916 0.985 0.94 0.108 0.419 0.967 0.539 Compound_1025 O=C(Nc1ccc(c(c1)C)C)CSc1nnnn1c1ccc2c(c1)OCO2 0.624 0.602 0.979 0.467 0.569 0.709 0.994 0.057 0.476 0.202 0.463 Compound_1026 COc1ccc(cc1)n1c(SCC(=O)Nc2nccs2)nc2c(c1=O)c1CCN(Cc1s2)C 0.637 0.579 0.28 0.305 0.332 0.777 0.261 0.012 0.399 0.011 0.137 Compound_1027 CCOP(=O)(C1(C=C(Br)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1)OCC 0.512 0.632 0.054 0.312 0.759 0.68 0.819 0.921 0.281 0.966 0.5 Compound_1028 O=C(c1ccc(cc1)OCc1c(C)noc1C)OCC(=O)N1c2ccccc2NC(=O)C1(C)C 0.484 0.774 0.922 0.553 0.69 0.645 0.787 0.114 0.385 0.627 0.818 Compound_1029 O=C(Nc1nc(C)cc(n1)C)CSc1nn(c(=S)s1)C 0.233 0.377 0.185 0.372 0.399 0.722 0.001 0.049 0.303 0.061 0.27 Compound_1030 COCc1c(C(=O)OCC)c2c(n1C)C(=O)C(=O)c1c2cc(Br)cc1 0.548 0.709 0.979 0.623 0.629 0.646 0.851 0.363 0.388 0.178 0.749 Compound_1031 Brc1ccc(o1)c1[nH]c2c(n1)cc(cc2)N1C(=O)c2c(C1=O)cccc2 0.542 0.564 0.874 0.413 0.672 0.649 0.949 0.394 0.521 0.883 0.566 Compound_1032 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN(C)C)c1ccc(cc1)F 0.628 0.675 0.519 0.56 0.907 0.727 0.56 0.46 0.399 0.119 0.308 Compound_1033 CCCCOC(=O)c1cc(O)c(c(c1)O)O 0.835 0.233 0.895 0.656 0.905 0.158 0.462 0.891 0.783 0.848 0.551 Compound_1034 OC1C(O)C(Oc2ccc3c(c2)CCC2C3CCC3(C2CC(C3O)O)C)OC(C1O)C(=O)O 0.571 0.871 0.005 0.406 0.889 0.826 0.678 0.735 0.108 0.918 0.439 Compound_1035 OC1CCCC=Cc2cc(O)cc(c2C(=O)OC(CCC1)C)O 0.948 0.474 0.742 0.632 0.928 0.906 0.783 0.938 0.449 0.988 0.143 Compound_1036 O=C(NC(=O)NCc1ccco1)CSCc1ccccc1C 0.102 0.492 0.496 0.303 0.172 0.559 0.217 0.048 0.378 0.009 0.18 Compound_1037 CCn1nnc(n1)NC(=O)CSc1ccc(cc1)Cl 0.357 0.417 0.894 0.479 0.4 0.756 0.065 0.111 0.238 0.049 0.5 Compound_1038 CCCSc1nc(C)c(cc1C#N)c1csc(n1)C(=C1CCCC1)C#N 0.652 0.622 0.965 0.641 0.553 0.825 0.166 0.859 0.748 0.214 0.859 Compound_1039 O=C(c1sc2c(c1)CSC2)NCc1ccco1 0.374 0.429 0.362 0.315 0.359 0.726 0.056 0.314 0.407 0.045 0.737 Compound_1040 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)OC 0.557 0.809 0.43 0.607 0.873 0.874 0.36 0.437 0.374 0.173 0.429 Compound_1041 COc1ccc(cc1n1nnnc1SCC(=O)NC(=O)NCc1ccco1)C 0.406 0.525 0.82 0.369 0.403 0.683 0.072 0.027 0.378 0.07 0.442 Compound_1042 CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)NC(=O)Cc1cccs1 0.434 0.483 0.192 0.454 0.24 0.52 0.047 0.268 0.378 0.05 0.108 Compound_1043 OC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccccn1 0.606 0.71 0.119 0.476 0.211 0.657 0.326 0.684 0.665 0.035 0.823 Compound_1044 CCOc1ccc(cc1)Nc1oc(nc1C#N)c1ccccc1Cl 0.333 0.645 0.997 0.801 0.802 0.647 0.697 0.98 0.517 0.838 0.94 Compound_1045 c1ccc(cc1)OCc1nnc2n1nc(s2)C1COc2c(O1)cccc2 0.354 0.654 0.29 0.491 0.357 0.678 0.188 0.78 0.401 0.153 0.688 Compound_1046 N#Cc1c(NC(=O)CSc2ncccn2)oc(c1c1ccccc1)c1ccccc1 0.322 0.443 0.723 0.522 0.62 0.66 0.994 0.482 0.523 0.012 0.729 Compound_1047 O=C(c1cc2c(s1)n(nc2C)c1ccccc1)OCN1C(=O)c2c(C1=O)cccc2 0.64 0.606 0.529 0.457 0.62 0.692 0.989 0.131 0.522 0.505 0.527 Compound_1048 COc1ccc(c(c1)N1C(=O)C2C(C1=O)C(=NO2)c1ccccc1Cl)OC 0.695 0.733 0.714 0.682 0.87 0.518 0.983 0.704 0.394 0.944 0.763 Compound_1049 COc1ccc(cc1)N1Cc2c(C1=O)c(ccc2)C(=O)N1CCN(CC1)C(=O)c1ccco1 0.278 0.726 0.482 0.509 0.256 0.552 0.731 0.551 0.411 0.093 0.206 Compound_1050 CCOC(=O)C1=c2n(C(=O)C(S1)c1ccccc1OC)c(c(c2=Cc1ccccc1OC)N)C#N 0.684 0.742 0.986 0.643 0.765 0.674 0.964 0.846 0.492 0.275 0.871 Compound_1051 Clc1ccc(cc1)C(=O)CSc1nc(O)c2c(n1)n(nc2)c1ccccc1 0.557 0.514 0.838 0.583 0.735 0.648 0.983 0.444 0.427 0.024 0.657 Compound_1052 OCCCC(=C(c1ccc(cc1)Br)c1ccc(cc1)N1CCN(CC1)C(C)C)c1ccccc1 0.543 0.473 0.6 0.274 0.283 0.675 0.008 0.235 0.412 0.026 0.258 Compound_1053 CN1CCN(CC1)CCOc1cccc(c1)C1Oc2cc(O)ccc2C2=C1c1ccc(cc1OCC2)O 0.617 0.761 0.141 0.464 0.931 0.665 0.089 0.178 0.231 0.36 0.241 Compound_1054 Fc1cccc(c1)C(CC(=O)c1ccc(cc1)C)Nc1ccc(cc1)N(=O)=O 0.777 0.613 0.928 0.62 0.622 0.917 0.968 0.984 0.347 0.899 0.692 Compound_1055 O=CC1=C(Sc2ccccc2)c2c(CC1)c1c(s2)nc2n(c1=O)CCCCC2 0.643 0.571 0.841 0.558 0.569 0.65 0.439 0.804 0.581 0.193 0.187 Compound_1056 Oc1ccc2c(c1C)oc(=O)c1c2cccc1C 0.932 0.714 0.866 0.539 0.912 0.989 0.989 0.977 0.866 0.035 0.517 Compound_1057 O=C1OC2CCC3(C1)C(=CCC1C3CCC3(C1CCC3O)C)C2 0.908 1.0 0.028 0.793 0.984 0.791 0.006 0.998 0.144 0.99 0.016 Compound_1058 CC(CN1CCc2c3c(C1c1ccc(cc1)C=CC(=O)O)c[nH]c3ccc2)C 0.565 0.576 0.118 0.257 0.705 0.68 0.993 0.231 0.459 0.072 0.287 Compound_1059 O=C(c1c(sc2c1cccc2)c1ccccc1)c1ccc(cc1)OCCN1CCCCC1 0.869 0.455 0.125 0.758 0.771 0.762 0.98 0.213 0.503 0.785 0.583 Compound_1060 O=CC1=C(Cl)c2sc3c(c2CCC1)c(=O)n1c(n3)CCCCC1 0.647 0.517 0.911 0.546 0.404 0.477 0.798 0.942 0.684 0.307 0.231 Compound_1061 Brc1ccc2c(c1)c(=O)oc1c2ccc(c1C)O 0.884 0.455 0.876 0.567 0.632 0.664 0.991 0.917 0.581 0.421 0.845 Compound_1062 OCCC1CCC(CC1)c1ccc(cc1)O 0.927 0.328 0.11 0.521 0.873 0.968 0.933 0.115 0.157 0.456 0.373 Compound_1063 COc1ccc(cc1)c1cccc(c1)c1ccc(cc1)OC 0.936 0.646 0.902 0.828 0.919 0.993 0.79 0.903 0.872 0.772 0.768 Compound_1064 Fc1ccc(cc1)n1ncc2c1ccc(c2)OC(C(NC(=O)C(F)(F)F)C)c1ccccc1 0.398 0.638 0.609 0.501 0.949 0.663 0.972 0.21 0.408 0.353 0.745 Compound_1065 ON=C1CCCC(CC1)c1ccc(cc1)O 0.86 0.406 0.624 0.584 0.587 0.933 0.925 0.553 0.391 0.371 0.669 Compound_1066 CC#CC1(O)CCC2C1(C)CC=C1C2CCC2=CC(=O)CCC12Cc1ccc(cc1)C 0.872 0.99 0.045 0.658 0.878 0.976 0.166 0.972 0.532 0.995 0.196 Compound_1067 CCCC(c1c[nH]c2c1c(ccc2)OCc1ccccc1)(c1ccc(c(c1)C)O)CCC 0.57 0.707 0.894 0.576 0.918 0.731 0.926 0.941 0.587 0.909 0.997 Compound_1068 COc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN(C)C)c1ccc(cc1)F 0.616 0.67 0.779 0.558 0.954 0.716 0.578 0.626 0.587 0.711 0.735 Compound_1069 CC(C(c1ccc2c(c1)OCCO2)Oc1ccc2c(c1)cnn2c1cccc(c1)C(=O)NCc1cccnc1)NC(=O)C(F)(F)C 0.685 0.773 0.724 0.552 0.812 0.677 0.857 0.513 0.381 0.015 0.711 Compound_1070 O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2O)C)C 0.987 1.0 0.028 0.862 0.938 0.904 0.01 0.924 0.049 0.989 0.179 Compound_1071 C=Cc1cc(O)cc2c1oc(n2)c1cc(F)c(c(c1)F)O 0.578 0.583 0.951 0.58 0.842 0.634 0.515 0.996 0.673 0.737 0.881 Compound_1072 OC(=O)C=Cc1ccc(cc1)C1(C)c2ccc(cc2CCN1c1ccccc1C(C)C)O 0.661 0.691 0.091 0.477 0.962 0.902 0.482 0.82 0.523 0.195 0.372 Compound_1073 OCC(=O)NC(C(c1ccc(cc1)S(=O)(=O)C)Oc1ccc2c(c1)cnn2c1ccc(cc1)F)C 0.365 0.536 0.862 0.449 0.779 0.661 0.942 0.073 0.385 0.146 0.401 Compound_1074 OC1CCCC(CC1)c1ccc(cc1)O 0.931 0.217 0.04 0.57 0.552 0.718 0.91 0.275 0.116 0.215 0.078 Compound_1075 CCCCC12CCC(=O)C=C2c2c(C1)c1cn[nH]c1cc2 0.84 0.804 0.708 0.52 0.762 0.68 0.63 0.536 0.541 0.747 0.874 Compound_1076 OCCCC(=C(c1cccc(c1)Br)c1ccc(cc1)N1CCN(CC1)C(C)C)c1ccccc1 0.54 0.473 0.707 0.274 0.635 0.622 0.008 0.235 0.415 0.026 0.258 Compound_1077 Cc1cc2c(=O)oc3c(c2c(c1Br)C)ccc(c3C)O 0.864 0.559 0.612 0.536 0.645 0.695 0.988 0.655 0.563 0.491 0.885 Compound_1078 Oc1ccc2c(c1C)oc(=O)c1c2cccc1 0.895 0.659 0.893 0.511 0.922 0.99 0.99 0.969 0.879 0.12 0.399 Compound_1079 COc1ccc2c(c1)c(=O)oc1c2ccc(c1C)O 0.808 0.786 0.888 0.653 0.898 0.962 0.993 0.518 0.859 0.011 0.789 Compound_1080 COc1cccc2c1c1ccc(cc1C(O2)c1cccc(c1)Cl)NS(=O)(=O)C 0.448 0.668 0.977 0.805 0.9 0.874 0.92 0.263 0.428 0.706 0.833 Compound_1081 COc1cccc2c1c1ccc(cc1C(O2)c1ccc(cc1)F)NS(=O)(=O)C 0.535 0.624 0.962 0.798 0.882 0.881 0.958 0.257 0.537 0.569 0.866 Compound_1082 OC1CC23C(=CCC4C3CCC3(C4CCC3O)C)C1C(=O)CC2 0.949 1.0 0.008 0.773 0.95 0.612 0.003 0.977 0.052 0.973 0.072 Compound_1083 OCCC1CCCC(CC1)c1ccc(cc1)O 0.929 0.22 0.11 0.538 0.567 0.796 0.949 0.14 0.096 0.054 0.222 Compound_1084 Oc1ccc2c(c1)OC(C1=C2CCOc2c1ccc(c2)O)c1cccc(c1)OCCN1CCSCC1 0.585 0.746 0.221 0.49 0.963 0.74 0.284 0.342 0.149 0.949 0.474 Compound_1085 O=C1CCC23C(=C1)C(CC1C3CCC3(C1CCC3O)C)C(C2)O 0.979 1.0 0.015 0.795 0.926 0.702 0.012 0.991 0.049 0.986 0.066 Compound_1086 OCCCC(=C(c1ccc(cc1)Br)c1ccc(cc1)N1CCNCC1)c1ccccc1 0.407 0.451 0.056 0.293 0.276 0.65 0.008 0.473 0.365 0.08 0.262 Compound_1087 Clc1ccc2c(c1)c1n(C)nc(c1CO2)C(=O)N(Cc1ccc(cc1)C(=O)O)Cc1ccccc1 0.678 0.747 0.403 0.594 0.716 0.73 0.986 0.755 0.369 0.305 0.602 Compound_1088 OC(=O)C=Cc1ccc(cc1)C(=O)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.904 0.695 0.507 0.58 0.93 0.83 0.878 0.916 0.774 0.81 0.551 Compound_1089 C=CC1OC2(OC1C=C)CCC1=Cc3c(CC21C)cnn3c1ccc(cc1)F 0.792 0.847 0.56 0.553 0.816 0.591 0.057 0.974 0.369 0.45 0.612 Compound_1090 O=CC1=C(SC2CCCC2)c2c(CC1)c1c(s2)nc2n(c1=O)CCCCC2 0.662 0.494 0.466 0.459 0.466 0.648 0.074 0.721 0.603 0.201 0.124 Compound_1091 CCN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)OC)c(=O)oc2c1ccc(c2)OC)CC 0.566 0.854 0.671 0.679 0.944 0.76 0.416 0.713 0.179 0.154 0.63 Compound_1092 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)OC 0.564 0.797 0.43 0.617 0.929 0.773 0.404 0.514 0.385 0.248 0.365 Compound_1093 CCCC(c1ccc(n1C)C(=O)O)(c1ccc(c(c1)C)O)CCC 0.587 0.639 0.088 0.461 0.576 0.804 0.792 0.868 0.558 0.091 0.728 Compound_1094 OC(=O)C1CC2(C1)CN(C2)c1ccc(c(c1Cl)n1c(nc(c1C)C1(CC1)C(F)(F)F)C1CC1)Cl 0.451 0.641 0.014 0.433 0.751 0.653 0.914 0.965 0.233 0.172 0.539 Compound_1095 CC(C(c1ccc2c(c1)cccc2)Oc1ccc2c(c1)cnn2c1ccc(cc1)F)NC(=O)C(F)(F)F 0.43 0.638 0.609 0.493 0.951 0.669 0.989 0.411 0.416 0.353 0.745 Compound_1096 CCN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)OC)CC 0.559 0.778 0.812 0.613 0.898 0.708 0.56 0.641 0.273 0.171 0.68 Compound_1097 COc1cccc(c1)C(C(NC(=O)C(F)(F)F)C)Oc1ccc2c(c1)cnn2c1ccc(cc1)F 0.475 0.706 0.614 0.507 0.93 0.643 0.962 0.177 0.404 0.086 0.748 Compound_1098 O=CC1=C(SC(C)(C)C)c2c(CC1)c1c(s2)nc2n(c1=O)CCCCC2 0.65 0.638 0.252 0.475 0.374 0.645 0.103 0.921 0.668 0.672 0.164 Compound_1099 CCN(CCOc1ccc(cc1)C(=C(c1ccccc1)C#N)c1ccc(cc1)OCCN(CC)CC)CC 0.35 0.613 0.077 0.649 0.97 0.842 0.013 0.565 0.114 0.165 0.649 Compound_1100 c1ccc(cc1)C1=Cc2c(C31Cc1c(C3)cccc1)cccc2 0.472 0.676 0.802 0.594 0.959 0.82 0.958 0.969 0.714 0.995 0.994 Compound_1101 CC#CC1(O)CC2CCc3c(C2(CC1O)CC)ccc(c3)O 0.95 0.755 0.093 0.625 0.941 0.98 0.734 0.519 0.29 0.994 0.82 Compound_1102 C=Cc1cccc2c1c1ccc(c(c1oc2=O)C)O 0.873 0.597 0.777 0.521 0.946 0.992 0.987 0.985 0.874 0.677 0.267 Compound_1103 COc1cccc2c1c1ccc(cc1C(O2)c1cccc(c1)F)NS(=O)(=O)C 0.499 0.624 0.977 0.805 0.882 0.881 0.958 0.263 0.463 0.569 0.866 Compound_1104 COc1ccc(cc1)C1Oc2ccc(cc2C(=O)C1C)O 0.568 0.843 0.581 0.633 0.968 0.946 0.829 0.173 0.318 0.016 0.842 Compound_1105 O=C1COc2c(N1)nc(cc2)N1CC(C)OCC1c1ccccc1 0.404 0.55 0.407 0.356 0.163 0.475 0.003 0.318 0.387 0.102 0.306 Compound_1106 COc1cc(C=Cc2ccc(cc2)C2=C(C3OC2C(C3)S(=O)(=O)Oc2ccccc2)c2ccc(cc2)O)cc(c1)OC 0.698 0.715 0.427 0.723 0.946 0.933 0.753 0.473 0.429 0.629 0.299 Compound_1107 Cc1c(O)ccc2c1oc(=O)c1c2c(C)ccc1 0.86 0.714 0.866 0.524 0.922 0.99 0.99 0.977 0.902 0.035 0.517 Compound_1108 O=CNc1ccc2c(c1C)c(=O)oc1c2ccc(c1C)O 0.755 0.832 0.955 0.647 0.856 0.981 0.977 0.92 0.92 0.122 0.355 Compound_1109 O=C1CCC2C(=C1)c1ccc(cc1C2)O 0.885 0.65 0.207 0.614 0.852 0.967 0.693 0.954 0.435 0.988 0.675 Compound_1110 COc1ccc2c(c1)CCC1=CC(=O)CCC21Cc1ccccc1 0.842 0.818 0.85 0.626 0.896 0.985 0.754 0.92 0.371 0.996 0.866 Compound_1111 C=CC12CCC(=O)C=C1CCC1C2CCC2(C1CCC2O)C 0.973 1.0 0.091 0.823 0.957 0.934 0.011 0.996 0.059 0.992 0.3 Compound_1112 CC#CC1(O)CCC2(C(C1)CCc1c2ccc(c1)OCc1cccnc1C)CC 0.731 0.76 0.026 0.618 0.676 0.913 0.009 0.613 0.319 0.967 0.891 Compound_1113 COc1ccccc1CNC(=O)c1cc(nn1c1cccc(c1)CNC(=O)C(N)C)C(F)(F)F 0.596 0.635 0.135 0.53 0.838 0.758 0.672 0.638 0.266 0.002 0.756 Compound_1114 C=CCC1C(O)CCC2(C1=CCC1C2CCC2(C1CCC2O)C)C=C 0.907 1.0 0.008 0.667 0.966 0.952 0.011 0.996 0.074 0.993 0.558 Compound_1115 COc1cccc2c1c1ccc(cc1C(O2)c1cccs1)NS(=O)(=O)C 0.526 0.643 0.602 0.653 0.746 0.888 0.943 0.818 0.511 0.497 0.521 Compound_1116 CC#CC1(O)CC(O)C2(C(C1)CCc1c2ccc(c1)O)CC 0.843 0.79 0.052 0.558 0.941 0.983 0.291 0.148 0.271 0.987 0.775 Compound_1117 CC1OC2(OC1C)CCC1=Cc3c(CC21C)cnn3c1ccc(cc1)F 0.806 0.807 0.436 0.492 0.795 0.558 0.064 0.851 0.353 0.915 0.512 Compound_1118 OC1CCC2C1(C)CCC1C2CC=C2C31CCOC(CC3)C2 0.944 0.99 0.025 0.763 0.986 0.855 0.003 0.986 0.283 0.971 0.201 Compound_1119 O=C1N(c2ccc(cc2)O)C(=O)c2c1cccc2 0.919 0.737 0.748 0.555 0.885 0.885 0.908 0.319 0.816 0.864 0.579 Compound_1120 CC12Cc3cnn(c3C=C1CCCC12OCCO1)c1ccc(cc1)F 0.807 0.85 0.461 0.521 0.799 0.625 0.219 0.932 0.454 0.536 0.568 Compound_1121 CC#CC1(O)CC2CCc3c(C2(CC1O)CC)ccc(c3)OCc1cccnc1C 0.719 0.787 0.023 0.645 0.533 0.85 0.011 0.628 0.297 0.504 0.869 Compound_1122 N#CC(=C(c1ccc(cc1)OCCN(C)C)c1ccc(cc1)OCCN(C)C)c1cccs1 0.564 0.543 0.01 0.548 0.82 0.815 0.048 0.275 0.677 0.153 0.632 Compound_1123 COc1ccc(cn1)C(C(NC(=O)C1CC1)C)Oc1ccc2c(c1)cnn2c1ccc(cc1)F 0.594 0.687 0.864 0.412 0.78 0.629 0.899 0.463 0.286 0.051 0.424 Compound_1124 CCN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)F)c(=O)oc2c1cccc2)CC 0.603 0.75 0.949 0.585 0.937 0.839 0.564 0.53 0.231 0.417 0.547 Compound_1125 COc1ccc2c(c1)oc(=O)c(c2Nc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)F 0.602 0.713 0.842 0.513 0.957 0.738 0.622 0.631 0.588 0.67 0.696 Compound_1126 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN(C)C)c1ccc(cc1)OC 0.558 0.72 0.405 0.632 0.942 0.932 0.336 0.409 0.271 0.087 0.35 Compound_1127 C=CC12CCC(=CC1=CCC1C2CCC2(C1CCC2O)C)c1ccccc1 0.898 0.95 0.042 0.605 0.887 0.939 0.034 0.997 0.31 0.983 0.738 Compound_1128 O=C(C(C)(C)C)Oc1ccc2c(c1)OC(C1=C2COc2c1ccc(c2)OC(=O)C(C)(C)C)c1ccc(cc1)OCCN1CCCCC1 0.565 0.818 0.268 0.362 0.545 0.648 0.432 0.733 0.307 0.971 0.198 Compound_1129 COc1cccc2c1c1ccc(cc1C(O2)c1ccc(cc1)C)NS(=O)(=O)C 0.483 0.704 0.833 0.696 0.884 0.92 0.954 0.485 0.463 0.907 0.787 Compound_1130 C=Cc1cc(OC)cc2c1c1ccc(c(c1oc2=O)C)O 0.814 0.734 0.797 0.619 0.927 0.97 0.994 0.819 0.901 0.234 0.551 Compound_1131 OCCCC(=C(c1ccc(cc1)C)c1ccc(cc1)N1CCN(CC1)CC)c1ccccc1 0.492 0.453 0.145 0.254 0.738 0.942 0.033 0.471 0.423 0.151 0.456 Compound_1132 COc1ccc2c(c1)oc(=O)c(c2Oc1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)F 0.597 0.726 0.619 0.558 0.881 0.725 0.751 0.5 0.417 0.464 0.356 Compound_1133 C=CC1OC2(OC1C=C)CCCC1=Cc3c(CC21C)cnn3c1ccc(cc1)F 0.794 0.847 0.56 0.565 0.815 0.633 0.124 0.967 0.406 0.45 0.612 Compound_1134 CN1CCC(C(C1)F)N1C(=O)SC(=Cc2ccc3c(c2)cnn3Cc2ccc(cc2C(F)(F)F)Cl)C1=O 0.539 0.677 0.826 0.418 0.853 0.546 0.909 0.907 0.394 0.319 0.207 Compound_1135 OCCCC(=C(c1ccc(cc1)C)c1ccc(cc1)N1CCN(CC1)C(C)C)c1ccccc1 0.492 0.523 0.249 0.253 0.728 0.944 0.025 0.139 0.418 0.02 0.397 Compound_1136 CCC12Cc3c(C2=CC(=O)CC1)ccc1c3cn[nH]1 0.813 0.806 0.708 0.508 0.762 0.68 0.63 0.564 0.525 0.311 0.915 Compound_1137 CCC12CC(O)C(CC1CCc1c2ccc(c1)OCc1cccnc1C)(O)c1ccccc1 0.485 0.829 0.023 0.634 0.849 0.905 0.065 0.621 0.185 0.063 0.967 Compound_1138 OCCCC(=C(c1ccc(cc1)C)c1ccc(cc1)N1CCNCC1)c1ccccc1 0.404 0.425 0.007 0.26 0.615 0.889 0.026 0.291 0.283 0.018 0.285 Compound_1139 COc1cccc2c1c1ccc(cc1C(O2)c1ccccc1)NS(=O)(=O)C 0.434 0.694 0.809 0.704 0.866 0.887 0.958 0.486 0.459 0.452 0.75 Compound_1140 CCC12CCC(=O)C=C2c2c(C1)cc(cc2)O 0.908 0.844 0.287 0.619 0.907 0.987 0.06 0.946 0.417 0.997 0.913 Compound_1141 OCCCC(=C(c1ccc(cc1)Br)c1ccc(cc1)N1CCN(CC1)C)c1ccccc1 0.553 0.46 0.566 0.327 0.279 0.657 0.004 0.431 0.415 0.015 0.204 Compound_1142 OCCCC(=C(c1ccc(cc1)C)c1ccc(cc1)N1CCN(CC1)C)c1ccccc1 0.52 0.453 0.073 0.33 0.738 0.942 0.033 0.131 0.426 0.004 0.209 Compound_1143 CC(C(c1ccc2c(c1)OCOC2)Oc1ccc2c(c1)cnn2c1cccc(c1)C(=O)NCc1cccnc1)NC(=O)C(F)(F)C 0.679 0.713 0.862 0.522 0.805 0.704 0.984 0.468 0.368 0.047 0.669 Compound_1144 N#CC(=C(c1ccc(cc1)OCCN1CCN(CC1)C)c1ccc(cc1)OCCN1CCN(CC1)C)c1ccccc1 0.307 0.567 0.031 0.715 0.939 0.719 0.016 0.498 0.583 0.029 0.443 Compound_1145 OCCC12CCC(=O)C(=C2c2c(C1)cc(cc2)O)C 0.904 0.938 0.315 0.554 0.915 0.99 0.091 0.896 0.126 0.944 0.448 Compound_1146 O=C1CCC2(C(=C1)c1ccc(cc1C2)O)Cc1ccccc1 0.886 0.804 0.348 0.598 0.99 1.0 0.391 0.977 0.484 0.986 0.787 Compound_1147 OCCCC(=C(c1ccc(cc1)Br)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.495 0.311 0.113 0.656 0.342 0.689 0.011 0.745 0.292 0.023 0.158 Compound_1148 OC(=O)C=Cc1ccc(cc1)Nc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.82 0.766 0.609 0.548 0.92 0.764 0.973 0.962 0.9 0.857 0.658 Compound_1149 Fc1ccc(cc1)n1ncc2c1ccc(c2)OC(C(NS(=O)(=O)C1CC1)C)c1ccccc1 0.497 0.447 0.637 0.436 0.856 0.719 0.913 0.252 0.345 0.334 0.603 Compound_1150 CSc1ccc(cc1)C(C(NS(=O)(=O)C1CC1)C)Oc1ccc2c(c1)cnn2c1ccc(cc1)F 0.488 0.428 0.711 0.433 0.847 0.693 0.897 0.152 0.351 0.298 0.523 Compound_1151 OCCCC(=C(c1ccc(cc1)C)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.45 0.338 0.005 0.751 0.892 0.991 0.012 0.664 0.129 0.005 0.045 Compound_1152 CCN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)F)c(=O)oc2c1ccc(c2)OC)CC 0.615 0.777 0.935 0.595 0.95 0.77 0.777 0.78 0.248 0.765 0.737 Compound_1153 COc1ccccc1CNC(=O)c1cc(nn1c1csc(c1)CNC(=O)C(N)C)C(F)(F)F 0.569 0.606 0.129 0.474 0.706 0.74 0.692 0.645 0.413 0.001 0.741 Compound_1154 N#Cc1ccc(cc1C)N1N=C(CC1C1CCCC1)c1ccc(c(n1)OC)C(=O)O 0.658 0.645 0.305 0.4 0.604 0.578 0.424 0.586 0.491 0.005 0.326 Compound_1155 CCN(CCOc1ccc(cc1)Oc1c(c2ccc(cc2)O)c(=O)oc2c1ccc(c2)O)CC 0.523 0.75 0.751 0.687 0.977 0.848 0.459 0.856 0.155 0.322 0.743 Compound_1156 CCOc1cccc2c1c1ccc(cc1C(O2)c1ccccc1)NS(=O)(=O)C 0.423 0.71 0.666 0.713 0.866 0.887 0.958 0.709 0.398 0.636 0.694 Compound_1157 Fc1ccc(cc1)c1c(=O)oc2c(c1Nc1ccc(cc1)OCCN1CCCC1)cccc2 0.59 0.685 0.855 0.523 0.952 0.88 0.614 0.417 0.556 0.671 0.611 Compound_1158 FC(Oc1cccc2c1c1ccc(cc1C(O2)c1ccccc1)NS(=O)(=O)C)F 0.478 0.593 0.809 0.768 0.94 0.85 0.948 0.264 0.414 0.756 0.865 Compound_1159 CN(CCOc1ccc(cc1)Nc1c(c2ccc(cc2)F)c(=O)oc2c1cccc2)C 0.586 0.623 0.815 0.568 0.937 0.839 0.564 0.391 0.562 0.127 0.545 Compound_1160 CCCC(c1ccc([nH]1)C(=O)O)(c1ccc(c(c1)C)O)CCC 0.493 0.582 0.025 0.33 0.77 0.692 0.676 0.037 0.557 0.16 0.635 Compound_1161 CC1CC(C)OC2(O1)CCC1=Cc3c(CC21C)cnn3c1ccc(cc1)F 0.811 0.807 0.412 0.491 0.747 0.579 0.02 0.84 0.545 0.93 0.5 Compound_1162 CC(C(c1ccc2c(c1)OCCO2)Oc1ccc2c(c1)cnn2c1cccc(c1)C(=O)NC1COCC1)NC(=O)C(F)(F)C 0.674 0.751 0.51 0.526 0.897 0.673 0.865 0.484 0.391 0.047 0.569 Compound_1163 OC(=O)C=Cc1ccc(cc1)c1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.888 0.722 0.758 0.567 0.947 0.817 0.839 0.946 0.863 0.955 0.36 Compound_1164 CC(C(c1ccc2c(c1)OCCO2)Oc1ccc2c(c1)cnn2c1cccc(c1)C(=O)NC1CCS(=O)(=O)C1)NC(=O)C(F)(F)C 0.632 0.713 0.42 0.581 0.859 0.677 0.861 0.523 0.411 0.12 0.421 Compound_1165 CC12Cc3cnn(c3C=C1CCC12OCCO1)c1ccc(cc1)F 0.808 0.85 0.461 0.501 0.803 0.58 0.107 0.847 0.419 0.536 0.568 Compound_1166 OCC1CCC(=CC1)c1ccc(cc1)O 0.959 0.51 0.064 0.633 0.778 0.982 0.674 0.75 0.396 0.308 0.677 Compound_1167 N#CC1=C(N)OC2=C(C1c1cocc1)CCCC2=Cc1cocc1 0.704 0.852 0.026 0.503 0.53 0.704 0.962 0.067 0.601 0.312 0.678 Compound_1168 C=CCn1c(SCC(=O)NC(=O)NCc2ccco2)nc2c(c1=O)cc(s2)CC 0.476 0.466 0.823 0.552 0.363 0.677 0.014 0.89 0.407 0.154 0.458 Compound_1169 Oc1ccc2c(c1)oc(=O)cc2CSc1nn2c(n1)nc(cc2C)C 0.619 0.631 0.503 0.461 0.697 0.743 0.877 0.358 0.134 0.082 0.765 Compound_1170 O=S(=O)(c1ccccc1)N=C(c1ccccc1)Sc1ccccc1 0.454 0.521 0.908 0.691 0.649 0.898 0.872 0.655 0.429 0.96 0.314 Compound_1171 CCC(C(c1ccc(cc1)OC(=O)CC)CC)c1ccc(cc1)OC(=O)CC 0.423 0.707 0.286 0.639 0.906 0.611 0.998 0.409 0.202 0.912 0.891 Compound_1172 Cc1cc(C)c(c(c1)C)S(=O)(=O)N=C1C=CC(=O)C(=C1)Cl 0.293 0.654 0.985 0.751 0.553 0.586 0.218 0.971 0.563 0.964 0.5 Compound_1173 COc1cc(ccc1OC)c1nnn(n1)CC(=O)c1c[nH]c2c1cccc2CC 0.321 0.761 0.992 0.598 0.548 0.678 0.866 0.855 0.583 0.065 0.734 Compound_1174 Cc1ccc(cc1)c1nnc(o1)c1ccc(cc1)NC(=O)c1ccco1 0.13 0.674 0.95 0.725 0.522 0.628 0.969 0.799 0.417 0.173 0.648 Compound_1175 CN1CCN(CC1)CCOc1ccc(cc1)n1c2c3ccc(cc3C(=O)c2c2c(c1=O)cc(cc2)O)O 0.704 0.654 0.349 0.71 0.767 0.551 0.357 0.783 0.423 0.115 0.375 Compound_1176 Cc1nc2n(c1c1scc(n1)c1cc3c(o1)cccc3)ccs2 0.543 0.766 0.961 0.522 0.659 0.653 0.979 0.891 0.55 0.718 0.359 Compound_1177 COc1nc(ccc1c1noc(n1)c1ccco1)c1ccc(cc1)Cl 0.407 0.637 0.819 0.735 0.656 0.655 0.936 0.887 0.557 0.084 0.298 Compound_1178 COc1cc2c(cc1O)CCC1C2CCC2(C1CCC2=O)C 0.939 0.877 0.068 0.429 0.915 0.827 0.089 0.208 0.053 0.855 0.891 Compound_1179 Oc1ccc(cc1)N=Nc1c([nH]n(c1=O)C(=S)N)c1ccc(cc1)N(=O)=O 0.525 0.537 0.95 0.63 0.84 0.746 0.972 0.827 0.707 0.274 0.746 Compound_1180 Nc1ccc(cc1)C(=C(c1ccc(cc1)O)c1ccc(cc1)O)C 0.896 0.748 0.849 0.577 0.997 1.0 0.969 0.928 0.912 0.665 0.986 Compound_1181 CNc1nnc(s1)c1cc2cc(Cl)ccc2oc1=O 0.552 0.742 0.953 0.532 0.167 0.62 0.122 0.514 0.37 0.549 0.491 Compound_1182 CCn1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cc2c(o1)ccc(c2)Br 0.537 0.52 1.0 0.775 0.69 0.654 0.979 0.609 0.431 0.611 0.422 Compound_1183 COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1cccs1 0.518 0.643 0.035 0.355 0.6 0.648 0.617 0.741 0.43 0.001 0.19 Compound_1184 N#CC1=C(N)Oc2c(C1c1cc3cc(CC)ccc3nc1O)ccc1c2nccc1 0.633 0.768 0.395 0.515 0.669 0.641 0.847 0.809 0.564 0.277 0.846 Compound_1185 O=C(C(Oc1ccc(cc1Cl)Cl)C)Nc1ccc2c(c1)nc(o2)c1ccncc1 0.317 0.634 1.001 0.806 0.614 0.643 0.991 0.929 0.518 0.49 0.74 Compound_1186 O=C(NC(=O)NCc1ccco1)CSc1ncnc2c1c(C)c(s2)C 0.33 0.503 0.98 0.445 0.456 0.663 0.102 0.379 0.402 0.013 0.352 Compound_1187 CCOC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nc2c(s1)cc(cc2)F 0.457 0.579 0.931 0.585 0.47 0.78 0.907 0.906 0.394 0.328 0.392 Compound_1188 O=C(NC(=O)NCc1ccco1)CSc1nnc(o1)c1ccc(cc1)OC(F)F 0.274 0.518 0.82 0.54 0.72 0.642 0.39 0.88 0.401 0.185 0.682 Compound_1189 COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OCC(=O)N1CCC(CC1)C 0.434 0.805 0.774 0.634 0.267 0.613 0.827 0.475 0.35 0.192 0.252 Compound_1190 CCn1c(SCC(=O)Nc2ccc3c(c2)oc2c3cccc2)nnc1c1ccc(cc1)N 0.353 0.506 0.996 0.762 0.597 0.717 0.998 0.935 0.398 0.33 0.551 Compound_1191 O=C(N1CCC(CC1)N1CCCCC1)Nc1ccc2c(c1)N(C)C(=O)CS2 0.379 0.465 0.112 0.455 0.76 0.455 0.016 0.556 0.476 0.08 0.082 Compound_1192 NCCNc1nc(NCc2ccccc2)c2c(c1C#N)CCN(C2)Cc1ccccc1 0.469 0.507 0.168 0.255 0.573 0.605 0.216 0.243 0.405 0.06 0.584 Compound_1193 O=C(CCC(=O)c1cccs1)OCC(=O)NCc1ccco1 0.174 0.569 0.247 0.433 0.194 0.626 0.184 0.534 0.406 0.442 0.483 Compound_1194 COc1cccc(c1)c1onc(c1)C(=O)Nc1cc(nn1c1ccccc1)C 0.384 0.718 0.597 0.636 0.737 0.726 0.827 0.938 0.511 0.242 0.475 Compound_1195 COc1ccc(cc1)N1Cc2c(C1=O)c(ccc2)C(=O)O 0.505 0.814 0.461 0.478 0.408 0.833 0.929 0.073 0.63 0.424 0.239 Compound_1196 COC(=O)C(C(=O)O)CC1(C)CC2CCC1CC2C(CCNC(=O)CCC(C)C)(C)C 0.1 0.387 0.045 0.227 0.129 0.506 0.449 0.247 0.322 0.008 0.143 Compound_1197 OC(=O)CCN1CCC2(CC1)C(=O)Nc1c2ccc(c1)C=C1c2ccccc2COc2c1ccc(c2)F 0.618 0.695 0.231 0.31 0.87 0.729 0.963 0.222 0.498 0.818 0.465 Compound_1198 O=C(Cc1cccs1)Nc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)C 0.255 0.384 0.162 0.336 0.272 0.589 0.269 0.264 0.373 0.005 0.19 Compound_1199 COc1ccc(cc1)c1nnc(n1N)SCC(=O)Nc1ccc2c(c1)c1ccccc1n2CC 0.637 0.569 0.991 0.711 0.627 0.769 0.992 0.819 0.396 0.05 0.512 Compound_1200 O=c1cc(oc2c1ccc1c2cccc1)c1ccco1 0.715 0.762 0.965 0.599 0.116 0.527 0.999 0.907 0.668 0.021 0.892 Compound_1201 COc1cc(ccc1OC)C1CC(=NN1S(=O)(=O)C)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl 0.673 0.617 0.811 0.646 0.784 0.635 0.792 0.908 0.393 0.654 0.405 Compound_1202 Fc1ccc(cc1)Nc1nc(CSc2nnnn2c2ccccc2)cc(n1)O 0.678 0.531 0.784 0.484 0.777 0.636 0.043 0.894 0.295 0.091 0.596 Compound_1203 OC(=O)CCn1ccnc1c1ccccc1 0.191 0.461 0.861 0.437 0.232 0.618 0.01 0.13 0.283 0.0 0.084 Compound_1204 CCOC(=O)c1c(C)[nH]c(c1C(=O)CSc1nnc(o1)c1cc(OC)c(c(c1)OC)OC)C 0.531 0.711 0.995 0.547 0.681 0.652 0.755 0.321 0.511 0.385 0.861 Compound_1205 COc1ccccc1NC(=O)c1ccccc1NC(=O)c1cc(Cl)ccc1NC(=O)c1ccco1 0.648 0.653 0.945 0.677 0.446 0.673 0.997 0.776 0.387 0.931 0.848 Compound_1206 Oc1ccc2c(c1)C(=O)CC1C2CCC2(C1CCC2O)C 0.954 0.95 0.003 0.568 0.988 1.0 0.159 0.575 0.044 0.995 0.721 Compound_1207 Cc1nn(c2c1cc(s2)C(=O)c1c(N)n(C)c(=O)n(c1=O)C)c1ccccc1 0.665 0.664 0.132 0.432 0.484 0.738 0.866 0.489 0.546 0.008 0.297 Compound_1208 CCOP(=O)(C1(C=C(Cl)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1)OCC 0.532 0.667 0.054 0.312 0.63 0.746 0.55 0.921 0.277 0.973 0.406 Compound_1209 Clc1ccc(cc1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2c(c1=O)cc1c(c2)OCO1 0.483 0.435 0.963 0.525 0.347 0.731 0.23 0.87 0.425 0.827 0.378 Compound_1210 Cc1ccc(cc1)CN(C(=O)N1CCOCC1)Cc1cc2cc(C)ccc2nc1O 0.486 0.607 0.927 0.56 0.855 0.586 0.847 0.719 0.411 0.15 0.198 Compound_1211 CCOC(=O)C(Oc1cccc2c1ccn(c2=O)CC(=O)Nc1ccc2c(c1)OCCO2)C 0.702 0.701 0.977 0.594 0.257 0.208 0.219 0.592 0.339 0.175 0.401 Compound_1212 COC(=O)c1ccc(o1)COC(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)C 0.219 0.691 0.217 0.419 0.046 0.313 0.441 0.056 0.365 0.097 0.222 Compound_1213 Oc1ccc2c(c1)C(O)CC1C2CCC2(C1CCC2O)C 0.912 0.961 0.008 0.504 0.983 0.985 0.015 0.313 0.049 0.997 0.849 Compound_1214 CCOc1ccccc1c1onc(n1)c1ccc(cc1)NC(=O)c1ccc(o1)Br 0.364 0.705 0.673 0.783 0.607 0.675 0.983 0.959 0.456 0.807 0.598 Compound_1215 COCCCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)c1ccccc1OC 0.649 0.814 0.39 0.559 0.589 0.625 0.925 0.604 0.403 0.025 0.216 Compound_1216 CCOC(=O)COc1ccc(cc1CC1CCCCC1)c1ccc(cc1)OCCN(C)C 0.184 0.406 0.02 0.504 0.345 0.807 0.285 0.875 0.387 0.041 0.193 Compound_1217 CCOc1ccccc1N1C(=O)NC(=O)C(C1=O)(CCc1ccncc1)CCc1ccncc1 0.455 0.521 0.11 0.393 0.438 0.541 0.109 0.249 0.383 0.08 0.682 Compound_1218 COc1cc(ccc1OC)CCn1c(SCC(=O)Nc2noc(c2)C)nc2c(c1=O)scc2 0.582 0.621 0.374 0.36 0.47 0.739 0.052 0.094 0.396 0.828 0.362 Compound_1219 Cc1c(C)cccc1N1CCN(CC1)C(=O)c1cc2c(n1C)c1ccccc1n(c2=O)C 0.642 0.738 0.549 0.515 0.717 0.398 0.866 0.817 0.449 0.117 0.077 Compound_1220 O=C(c1ccc(s1)Br)NCCCCCCNC(=O)c1ccc(s1)Br 0.266 0.412 0.145 0.308 0.442 0.713 0.278 0.962 0.527 0.054 0.356 Compound_1221 Clc1ccc(cc1)n1nc(c2c1sc(c2)C(=O)N1CCN(CC1)c1ccccn1)C 0.576 0.638 0.285 0.379 0.575 0.674 0.964 0.95 0.438 0.08 0.046 Compound_1222 O=C(c1noc(c1)c1ccc2c(c1)OCO2)Nc1cccnc1 0.224 0.72 0.994 0.659 0.415 0.646 0.366 0.967 0.585 0.18 0.762 Compound_1223 COc1ccc(cc1)c1ccc(c(n1)OC)c1noc(n1)c1cccs1 0.485 0.713 0.978 0.667 0.723 0.723 0.967 0.973 0.902 0.047 0.329 Compound_1224 COC(=O)c1ccc(o1)CSc1nc(O)c2c(n1)n(nc2)c1ccc(cc1)F 0.535 0.536 0.41 0.504 0.673 0.649 0.97 0.189 0.803 0.019 0.679 Compound_1225 COc1cc(NC(=O)c2cc3c(n2C)c2ccccc2n(c3=O)C)cc(c1OC)OC 0.744 0.707 0.996 0.633 0.718 0.633 0.89 0.72 0.85 0.071 0.568 Compound_1226 O=C(Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCCC1)NC1CCCCC1 0.273 0.483 0.692 0.51 0.345 0.602 0.143 0.461 0.39 0.298 0.253 Compound_1227 Oc1ccc(cc1)C1CC(=O)N1c1ccc(cc1)O 0.667 0.499 0.387 0.584 0.622 0.702 0.528 0.415 0.447 0.02 0.531 Compound_1228 Fc1ccc(c(c1)NC(=O)c1cccc2c1nccn2)C 0.562 0.708 0.944 0.68 0.156 0.188 0.774 0.889 0.59 0.555 0.657 Compound_1229 CCN(S(=O)(=O)c1cc(ccc1C)C(=O)O)c1ccccc1 0.331 0.481 0.124 0.332 0.299 0.788 0.161 0.254 0.297 0.05 0.191 Compound_1230 O=C(c1cccc(c1)NC(=O)c1ccco1)Nc1cccc(c1)c1cnc2c(n1)cccc2 0.389 0.658 0.591 0.666 0.207 0.535 0.983 0.868 0.409 0.241 0.959 Compound_1231 Cc1ccc2c(c1)nc(cc2)C1C(=O)c2c(C1=O)cccc2 0.365 0.818 0.991 0.473 0.887 0.906 0.938 0.988 0.925 0.014 0.957 Compound_1232 COc1cc(cc(c1OC)OC)C(=O)Nc1nnc(s1)c1sccc1C 0.505 0.737 0.951 0.634 0.465 0.727 0.952 0.567 0.405 0.283 0.517 Compound_1233 CCCCCCCCOC(=O)c1cc(I)c(c(c1)I)O 0.906 0.35 0.92 0.696 0.965 0.403 0.868 0.702 0.466 0.947 0.8 Compound_1234 CC=C(C(=CC)c1ccc(cc1)O)c1ccc(cc1)O 0.952 0.835 0.782 0.564 0.936 0.983 0.347 0.996 0.642 0.943 0.978 Compound_1235 Oc1nc2c(C)cccc2cc1C(c1nnnn1C(C)(C)C)N(Cc1ccco1)CC1CCCO1 0.644 0.734 0.177 0.325 0.683 0.648 0.801 0.543 0.276 0.978 0.216 Compound_1236 COc1ccc(cc1)C(=O)Nc1nc(O)c2c(n1)cc(c(c2)OC)OC 0.383 0.6 0.82 0.648 0.832 0.641 0.624 0.155 0.666 0.153 0.829 Compound_1237 CC(CCNC(=O)COc1ccc2c(c1)oc(=O)c1c2CCC1)C 0.544 0.745 0.788 0.462 0.043 0.384 0.24 0.487 0.302 0.437 0.022 Compound_1238 O=C(c1nc2c(s1)cccc2)Nc1c(oc2c1cccc2)C(=O)N 0.54 0.706 0.993 0.547 0.5 0.669 0.984 0.464 0.538 0.726 0.808 Compound_1239 CCCc1nnc2n1N=C(CS2)c1ccc(o1)c1cc(Cl)ccc1Cl 0.51 0.608 0.954 0.66 0.557 0.708 0.807 0.895 0.582 0.041 0.441 Compound_1240 O=C(Cc1cccs1)Nc1ccccn1 0.303 0.638 0.531 0.346 0.091 0.732 0.015 0.737 0.652 0.111 0.087 Compound_1241 O=c1cc(COC(=O)c2[nH]nc3c2cccc3)c2c(o1)cc(c(c2)C)C 0.697 0.68 0.993 0.443 0.882 0.74 0.985 0.627 0.8 0.28 0.884 Compound_1242 Clc1ccc(s1)S(=O)(=O)NCc1csc(n1)c1cccnc1 0.563 0.314 0.497 0.487 0.589 0.666 0.078 0.97 0.412 0.035 0.17 Compound_1243 CN(Cc1nc(O)c2c(n1)cccc2)CC(=O)NC(=O)NCc1ccco1 0.197 0.474 0.361 0.224 0.645 0.636 0.075 0.249 0.371 0.26 0.403 Compound_1244 Cc1ccc(o1)C=C1SC2N(C1=O)NC(N2)c1ccco1 0.49 0.527 0.11 0.498 0.5 0.651 0.024 0.754 0.409 0.635 0.468 Compound_1245 CCOC(=O)Cc1cc(O)n2c(n1)cc(n2)c1ccc(cc1)C 0.578 0.581 0.53 0.71 0.795 0.646 0.955 0.944 0.196 0.01 0.644 Compound_1246 Oc1ccc2c(c1)oc(=O)c(c2)C(=O)NCc1ccco1 0.306 0.579 0.852 0.473 0.054 0.406 0.126 0.855 0.309 0.694 0.606 Compound_1247 CCSc1nc(O)c2c(n1)n(nc2)c1ccc(cc1)C 0.524 0.558 0.866 0.49 0.668 0.64 0.139 0.122 0.414 0.226 0.553 Compound_1248 O=C(c1ccco1)Nc1ccc2c(c1)nc1n2CCSC1 0.343 0.513 0.871 0.718 0.434 0.59 0.043 0.394 0.356 0.122 0.086 Compound_1249 Cc1ccc(cc1)Cn1c(NC(=O)c2ccco2)nc2c1cccc2 0.192 0.641 0.46 0.532 0.307 0.665 0.931 0.309 0.443 0.24 0.616 Compound_1250 CCN(c1ccc2c(c1)oc(=O)c1c2oc(=O)cc1Cl)CC 0.656 0.736 0.982 0.681 0.658 0.635 0.978 0.982 0.79 0.98 0.767 Compound_1251 CCOc1cc(N2CCOCC2)c(cc1NC(=O)c1cc(nc2c1cccc2)c1ccco1)OCC 0.499 0.72 0.919 0.627 0.484 0.573 0.998 0.826 0.407 0.759 0.825 Compound_1252 COc1cc(NC(=O)c2cccs2)c(cc1OC)C(=O)OCC(=O)NCc1ccco1 0.49 0.644 0.934 0.507 0.493 0.626 0.059 0.438 0.406 0.074 0.512 Compound_1253 COC(=O)c1ccc2c(c1)[nH]c(=O)n(c2=O)CCCCCC(=O)NCc1ccc2c(c1)OCO2 0.505 0.591 0.975 0.421 0.115 0.729 0.749 0.267 0.365 0.061 0.373 Compound_1254 C=CCn1c(SCC(=O)NC(=O)NCc2ccco2)nnc1COc1cccc(c1)C 0.479 0.519 0.846 0.48 0.249 0.688 0.096 0.785 0.397 0.542 0.538 Compound_1255 O=C(Nc1ccccc1C)CSc1nnc(c(n1)c1ccco1)c1ccco1 0.348 0.526 0.925 0.56 0.54 0.662 0.874 0.099 0.396 0.002 0.424 Compound_1256 O=C(Nc1cccc(c1)NC(=O)c1ccco1)CSc1nnnn1c1ccc(c(c1)C)C 0.518 0.541 0.912 0.54 0.461 0.687 0.989 0.269 0.399 0.065 0.467 Compound_1257 N#Cc1ccc(nc1SCC(=O)Nc1sc2c(c1C#N)CCC2)c1cccnc1 0.654 0.562 0.614 0.625 0.559 0.669 0.864 0.834 0.501 0.065 0.658 Compound_1258 COc1cc(ccc1Oc1ccc(cc1C(F)(F)F)C#N)C=C1SC(=O)NC1=O 0.592 0.544 0.752 0.481 0.871 0.72 0.858 0.752 0.412 0.392 0.86 Compound_1259 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)OCCN1CCCC1)c1ccc(cc1)S(=O)(=O)C 0.362 0.679 0.269 0.493 0.733 0.739 0.033 0.519 0.38 0.814 0.448 Compound_1260 COc1nnc(c2c1cccc2)c1ccc(cc1)C(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1 0.625 0.685 0.888 0.514 0.523 0.794 0.944 0.9 0.687 0.003 0.285 Compound_1261 O=C(c1ccccc1)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCOCC1 0.518 0.516 0.213 0.619 0.395 0.805 0.985 0.466 0.387 0.211 0.221 Compound_1262 Clc1ccc(c(c1)Cl)c1sc2n(n1)c(nn2)c1[nH]nc(c1)C 0.52 0.632 0.439 0.619 0.674 0.653 0.773 0.403 0.494 0.255 0.177 Compound_1263 COc1ccc2c(c1)cc1c(n2)oc(c1)C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F 0.242 0.596 0.976 0.656 0.661 0.646 0.987 0.872 0.416 0.02 0.387 Compound_1264 Brc1cncc(c1)C(=O)Nc1ccc2c(c1)nc(o2)c1ccccc1F 0.461 0.66 1.001 0.864 0.646 0.642 0.973 0.861 0.288 0.768 0.606 Compound_1265 CN(CC(=O)N1c2cc(ccc2CCc2c1cccc2)NC(=O)c1ccc(cc1)N)C 0.313 0.647 0.232 0.298 0.843 0.692 0.781 0.053 0.406 0.029 0.314 Compound_1266 OC(=O)C1Nc2c(cccc2C2C1CC=C2)C(=O)N1CCOCC1 0.715 0.531 0.236 0.341 0.304 0.165 0.254 0.165 0.334 0.891 0.521 Compound_1267 CC(CNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccccn1)C 0.478 0.64 0.121 0.356 0.454 0.59 0.651 0.798 0.329 0.001 0.214 Compound_1268 CCCCCC(C1C(=O)OC2(C1CC1=C(C2=O)COC(=C1)C=CC)C)O 0.833 1.0 0.051 0.593 0.055 0.287 0.757 0.958 0.377 0.723 0.353 Compound_1269 CCOC(=O)c1c(C)oc2c1c(C=NC1CCS(=O)(=O)C1)c(O)c1c2cccc1 0.467 0.751 0.592 0.527 0.556 0.793 0.986 0.609 0.463 0.272 0.446 Compound_1270 CCOc1ccccc1N1CSC2=C(C#N)C(CC(=O)N2C1)c1c(OC)ccc2c1cccc2 0.641 0.668 0.144 0.455 0.873 0.59 0.76 0.946 0.434 0.108 0.548 Compound_1271 CCCCCCCCOC(=O)c1cc(C)c(c(c1)C)O 0.778 0.419 0.746 0.651 0.787 0.97 0.761 0.38 0.866 0.838 0.802 Compound_1272 COc1ccc(c(c1)C=Nc1oc(c(c1C#N)c1ccco1)c1ccco1)OC 0.455 0.537 0.954 0.717 0.625 0.646 0.996 0.703 0.55 0.775 0.708 Compound_1273 CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3c(n2Cc2ccccc2)cccc3)C(=O)CCC1 0.589 0.664 0.92 0.537 0.688 0.822 0.994 0.956 0.359 0.024 0.622 Compound_1274 O=C(NCc1ccco1)COC(=O)CCOc1ccccc1 0.037 0.561 0.26 0.54 0.017 0.213 0.22 0.749 0.399 0.398 0.138 Compound_1275 CCCN(S(=O)(=O)c1ccc(cc1)NC(=O)Cc1cccs1)CCC 0.303 0.383 0.192 0.433 0.255 0.499 0.076 0.254 0.367 0.111 0.146 Compound_1276 Oc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O 0.952 0.937 0.989 0.918 0.925 0.984 0.998 0.964 0.95 0.078 0.983 Compound_1277 Cc1csc2n1cc(n2)CCNS(=O)(=O)c1ccc2c(c1)OCCO2 0.441 0.539 0.006 0.244 0.395 0.669 0.061 0.431 0.227 0.02 0.169 Compound_1278 N#Cc1ccsc1NC(=O)CSc1nnc(n1C)c1ccccc1 0.505 0.508 0.895 0.632 0.352 0.701 0.622 0.839 0.565 0.033 0.545 Compound_1279 COc1ccc2c(c1)c1CCn3c(c1[nH]2)nc1c(c3=O)cccc1 0.534 0.726 0.979 0.587 0.621 0.71 0.909 0.313 0.493 0.009 0.076 Compound_1280 O=C(Nc1cc(ccc1C)c1nn2c(s1)nnc2C)COc1ccc(cc1)Cl 0.552 0.69 0.445 0.631 0.372 0.762 0.88 0.687 0.401 0.276 0.405 Compound_1281 O=C(NC(=O)NCc1ccco1)CSc1nnc(s1)Nc1ccccc1C 0.312 0.571 0.745 0.354 0.573 0.666 0.06 0.203 0.4 0.006 0.367 Compound_1282 COc1ccc(cc1)Cn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccco1 0.553 0.606 0.679 0.512 0.647 0.668 0.813 0.543 0.329 0.009 0.7 Compound_1283 COc1cccc(c1)n1nnnc1SCC(=O)Nc1ccc(cc1)C(=O)C 0.687 0.567 0.953 0.495 0.554 0.803 0.994 0.039 0.404 0.021 0.355 Compound_1284 COc1ccccc1C=C1SC2N(C1=O)NC(N2)c1ccco1 0.486 0.592 0.128 0.451 0.365 0.636 0.151 0.211 0.408 0.7 0.465 Compound_1285 O=C(Nc1nnc(s1)C)CSc1nc2CC(Sc2c(=O)n1CCc1ccccc1)C 0.518 0.518 0.58 0.415 0.135 0.731 0.816 0.593 0.391 0.018 0.201 Compound_1286 CCOc1ccccc1C1C(=C(N)Nc2c1c(no2)c1ccccc1)C#N 0.536 0.749 0.938 0.676 0.94 0.784 0.986 0.977 0.44 0.101 0.691 Compound_1287 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCN1CCCC1 0.776 0.661 0.105 0.685 0.947 0.957 0.537 0.554 0.454 0.073 0.301 Compound_1288 Clc1ccc2c(c1)nc1c(c2)cc(o1)C(=O)NCc1ccco1 0.332 0.565 0.952 0.465 0.722 0.638 0.943 0.955 0.304 0.038 0.694 Compound_1289 O=Cc1ccc2c(c1)c(=O)c1c(o2)nc2n(c1=O)CCCS2 0.564 0.643 0.585 0.575 0.166 0.669 0.532 0.825 0.41 0.326 0.494 Compound_1290 CN(c1cnn(c(=O)c1Cl)c1ccc(c(c1)Cl)F)N=Cc1cccnc1 0.61 0.623 0.569 0.536 0.821 0.613 0.868 0.54 0.556 0.023 0.215 Compound_1291 COc1ccc2c(c1)c(=O)oc1c2ccc(c1)OCC(=O)NC1CCCCC1 0.294 0.665 0.735 0.628 0.365 0.694 0.858 0.459 0.329 0.441 0.164 Compound_1292 Brc1cnc2n(c1)nc(c2)C(=O)N1CCN(CC1)C(=O)c1ccco1 0.216 0.663 0.04 0.519 0.57 0.642 0.374 0.966 0.394 0.068 0.119 Compound_1293 O=C(NCc1ccco1)COC(=O)c1ccccc1Oc1ccccc1 0.128 0.607 0.78 0.4 0.022 0.302 0.768 0.203 0.398 0.337 0.193 Compound_1294 O=c1oc2c(n1CCn1c3nc4ccccc4nc3c3c1cccc3)cccc2 0.487 0.619 0.979 0.595 0.831 0.698 0.966 0.961 0.343 0.074 0.11 Compound_1295 O=S(=O)(c1cccs1)NCc1csc(n1)c1cccnc1 0.511 0.352 0.688 0.508 0.562 0.664 0.037 0.976 0.393 0.008 0.099 Compound_1296 Cc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)O 0.244 0.548 0.235 0.288 0.102 0.312 0.517 0.07 0.392 0.02 0.126 Compound_1297 CCC(=C(c1ccc(cc1)OC(=O)CC)CC)c1ccc(cc1)OC(=O)CC 0.539 0.662 0.315 0.659 0.874 0.638 0.997 0.698 0.171 0.998 0.982 Compound_1298 CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1ccccc1OC)CC 0.413 0.789 0.903 0.677 0.425 0.795 0.947 0.981 0.478 0.975 0.551 Compound_1299 O=C(CN1C(=O)SC(=Cc2ccc(o2)c2cc(ccc2C)C(=O)O)C1=O)Nc1ccc(c(c1)C)C 0.365 0.532 0.581 0.616 0.363 0.608 0.997 0.955 0.416 0.974 0.299 Compound_1300 Clc1ccc(cc1)Nc1scc(n1)c1ccncc1 0.602 0.756 0.968 0.733 0.254 0.855 0.25 0.939 0.648 0.357 0.073 Compound_1301 CCC1(C)NC(=O)N(C1=O)CC(=O)Nc1sc2c(c1C(=O)N)CCC2 0.488 0.44 0.091 0.3 0.225 0.452 0.035 0.122 0.373 0.034 0.435 Compound_1302 O=C1CCCC2=C1C(C1=C(O2)CC(CC1=O)(C)C)c1cc2c(n1Cc1ccccc1)cccc2 0.598 0.701 0.962 0.547 0.713 0.829 0.994 0.962 0.361 0.003 0.667 Compound_1303 O=C(Cc1cccs1)Nc1cccc(c1)C(=O)C 0.471 0.548 0.879 0.52 0.284 0.752 0.89 0.565 0.701 0.333 0.198 Compound_1304 O=C(c1nc(n(n1)c1ccccc1)c1ccccc1)Nc1nccs1 0.673 0.582 0.95 0.676 0.384 0.729 0.966 0.745 0.863 0.239 0.148 Compound_1305 O=N(=O)c1ccccc1NC(=O)C1=C(O)CCn2c1nc1c2cccc1 0.432 0.672 0.526 0.502 0.598 0.505 0.446 0.87 0.454 0.21 0.562 Compound_1306 OC(=O)c1ccccc1N(S(=O)(=O)c1ccc2c3c1cccc3c(=O)[nH]2)C 0.545 0.724 0.343 0.575 0.306 0.602 0.631 0.414 0.44 0.481 0.397 Compound_1307 CCN(CCOc1ccc(cc1)n1c2c3ccc(cc3C(=O)c2c2c(c1=O)cc(cc2)OC)OC)CC 0.694 0.727 0.189 0.683 0.718 0.586 0.295 0.764 0.187 0.339 0.612 Compound_1308 COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)CCCC(=O)N1CCN(CC1)c1cccc(c1)Cl 0.446 0.55 0.48 0.521 0.392 0.704 0.865 0.482 0.433 0.564 0.365 Compound_1309 CCOc1ccc(cc1)NC1=NC(=O)SC1=Cc1ccc(cc1)OC 0.428 0.743 0.869 0.722 0.693 0.928 0.333 0.883 0.18 0.143 0.609 Compound_1310 COc1ccc(cc1)Cn1c(=O)[nH]c2c(c1=O)ccc(c2)C(=O)NCc1ccc2c(c1)OCO2 0.58 0.657 0.966 0.512 0.291 0.754 0.773 0.349 0.338 0.007 0.443 Compound_1311 COc1ccc(cc1)c1cn2c(n1)sc(c2C)C(=O)Nc1ccncc1 0.378 0.736 0.952 0.758 0.515 0.681 0.965 0.514 0.706 0.176 0.306 Compound_1312 COc1ccccc1C(=O)Nc1nc(c(s1)NC(=O)C)c1cccs1 0.533 0.671 0.937 0.675 0.301 0.829 0.911 0.31 0.864 0.069 0.603 Compound_1313 O=C(Cc1cccs1)Nc1nnc(s1)C 0.284 0.575 0.553 0.379 0.146 0.709 0.481 0.678 0.36 0.032 0.293 Compound_1314 COc1cccc(c1)c1nnc(s1)NC(=O)Cc1cccs1 0.371 0.634 0.873 0.654 0.275 0.733 0.88 0.969 0.414 0.038 0.285 Compound_1315 Clc1ccc(s1)S(=O)(=O)NCCc1csc(n1)c1cccnc1 0.347 0.329 0.402 0.449 0.59 0.668 0.095 0.981 0.366 0.043 0.162 Compound_1316 Brc1ccc(cc1)C1NC(=O)c2c(N1)sc1c2CCC1 0.616 0.67 0.218 0.35 0.426 0.646 0.013 0.306 0.511 0.804 0.316 Compound_1317 COCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1 0.591 0.639 0.109 0.444 0.404 0.622 0.97 0.384 0.496 0.056 0.827 Compound_1318 N#CC1=C(N)Oc2c(C1c1cc3cc(C)ccc3nc1O)ccc1c2nccc1 0.624 0.817 0.846 0.507 0.669 0.641 0.847 0.917 0.58 0.374 0.806 Compound_1319 COC(=O)C1=C(O)C(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccc(c(c2)C)C)N=C1C 0.546 0.606 0.871 0.618 0.188 0.35 0.404 0.8 0.434 0.204 0.742 Compound_1320 O=Cc1cn(nc1c1cc2c(oc1=O)ccc1c2cccc1)c1ccccc1 0.404 0.759 0.717 0.606 0.785 0.641 0.977 0.638 0.94 0.072 0.739 Compound_1321 O=C(c1ccoc1C)NCc1cccc(c1)CNC(=O)c1ccoc1C 0.307 0.484 0.736 0.358 0.075 0.629 0.225 0.071 0.753 0.032 0.692 Compound_1322 Oc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCN2CCOCC2)c(=O)c2c1ccc(c2)O 0.768 0.664 0.429 0.758 0.967 0.955 0.319 0.948 0.285 0.852 0.483 Compound_1323 Clc1ccc(cc1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.419 0.353 0.929 0.527 0.4 0.729 0.214 0.87 0.458 0.676 0.215 Compound_1324 Cc1ccc(cc1)NC=C1C(=O)N(c2ccc3c(c2)OCO3)C(=O)c2c1cccc2 0.599 0.794 0.998 0.414 0.459 0.635 0.792 0.67 0.537 0.096 0.695 Compound_1325 CC1CC(n2c(N1)cc(n2)C(=O)O)C(C(F)(F)F)(F)F 0.237 0.399 0.173 0.407 0.484 0.564 0.157 0.173 0.144 0.004 0.312 Compound_1326 CC(C(c1ccc(cc1)S(=O)(=O)C)Oc1ccc2c(c1)cnn2c1ccc(cc1)F)NS(=O)(=O)C1CC1 0.505 0.438 0.661 0.401 0.847 0.694 0.91 0.246 0.396 0.38 0.516 Compound_1327 Cc1ccc2c(c1)nc(n2c1ccncc1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3 0.482 0.703 0.282 0.568 0.537 0.652 0.994 0.284 0.579 0.002 0.215 Compound_1328 Fc1ccc(cc1)C(N1C(=O)OC(C1=O)(Cc1ccccc1)c1nc2c([nH]1)cccc2NS(=O)(=O)C)C 0.565 0.7 1.0 0.642 0.51 0.673 0.991 0.885 0.405 0.56 0.577 Compound_1329 COc1ccc(cc1)c1nnc(o1)c1cc2c(oc1=O)ccc1c2cccc1 0.386 0.825 0.933 0.801 0.738 0.663 0.997 0.888 0.647 0.165 0.7 Compound_1330 CCOC(=O)C1CCCN(C1)C(=O)c1nn2c(c1)ncc(c2)Br 0.461 0.717 0.061 0.569 0.393 0.609 0.061 0.85 0.376 0.132 0.197 Compound_1331 O=C(Nc1nsc(n1)c1ccc(cc1)Cl)CSc1nnnn1c1ccccc1 0.369 0.398 0.381 0.601 0.448 0.866 0.899 0.238 0.392 0.078 0.464 Compound_1332 COC(=O)c1ccc2c(c1)nc(n(c2=O)CC1CCCO1)SCC(=O)Nc1ccccc1Cl 0.564 0.521 0.588 0.589 0.567 0.594 0.988 0.421 0.402 0.874 0.394 Compound_1333 CC(=O)Nc1ccc2c(c1)c(O)cc(n2)C 0.406 0.82 0.829 0.669 0.533 0.735 0.095 0.983 0.719 0.213 0.816 Compound_1334 CCc1nn2c(=NC(=O)C(=Cc3ccc(o3)SCc3ccco3)C2=N)s1 0.627 0.557 0.961 0.618 0.239 0.821 0.307 0.996 0.437 0.027 0.571 Compound_1335 Cc1ccc(cc1)C(=O)NN=Cc1ccc(s1)N(=O)=O 0.635 0.436 0.958 0.373 0.35 0.563 0.487 0.982 0.424 0.97 0.486 Compound_1336 O=C(Nc1ccc2c(c1)nc(o2)c1cccnc1)Cc1ccccc1 0.157 0.562 0.999 0.797 0.592 0.624 0.987 0.917 0.479 0.098 0.65 Compound_1337 O=C(c1ccco1)CSc1nnc(s1)SCC(=O)c1ccco1 0.455 0.533 0.65 0.538 0.553 0.645 0.992 0.843 0.411 0.241 0.895 Compound_1338 Cc1nc2ccccc2c(c1)c1sc2n(n1)c(nn2)c1ccccc1 0.624 0.667 0.947 0.765 0.59 0.704 0.798 0.947 0.501 0.21 0.213 Compound_1339 COc1ccc(cc1)C1C=C(Nc2n1nc(n2)NC(=O)C)c1ccc(cc1)Cl 0.65 0.686 0.879 0.492 0.316 0.917 0.097 0.209 0.494 0.39 0.677 Compound_1340 COc1cc2cc(c(nc2cc1OC)O)C(N1CCc2c1cccc2)c1nnnn1C1CCCC1 0.617 0.728 0.947 0.494 0.752 0.647 0.756 0.675 0.616 0.008 0.087 Compound_1341 CSC1=NC(=Cc2ccc(o2)Br)C(=O)S1 0.41 0.495 0.336 0.47 0.552 0.649 0.783 0.976 0.391 0.532 0.787 Compound_1342 COc1ccc(cc1NC(=O)c1n[nH]c(c1)c1ccc(cc1O)C)OC 0.643 0.691 0.915 0.704 0.821 0.665 0.801 0.855 0.335 0.796 0.858 Compound_1343 CC(C(Cc1ccc(c(c1)O)O)C)Cc1ccc(c(c1)O)O 0.959 0.573 0.468 0.613 0.956 0.364 0.867 0.977 0.145 0.989 0.465 Compound_1344 O=C(Nc1nc(c(o1)c1ccccc1)c1ccccc1)CSc1nnnn1C 0.203 0.528 0.756 0.576 0.585 0.656 0.965 0.366 0.432 0.136 0.404 Compound_1345 O=C(Nc1cc2C(=O)c3ccccc3C(=O)c2cc1Cl)COC(=O)CC1CCCC1 0.613 0.623 0.582 0.567 0.625 0.782 0.991 0.98 0.404 0.926 0.566 Compound_1346 CC(CC(=O)Nc1ccc(cc1)C(=O)COc1ccc(cc1)c1ocnn1)C 0.21 0.684 0.925 0.763 0.523 0.66 0.969 0.93 0.418 0.185 0.639 Compound_1347 O=S(=O)(c1cccc(c1)c1nc2n(c1)cccn2)N1CCCCCC1 0.311 0.391 0.088 0.598 0.536 0.703 0.356 0.159 0.349 0.047 0.304 Compound_1348 Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)C=Cc1ccccc1)c1ccc(cc1)O 0.685 0.639 0.824 0.763 0.986 0.98 0.722 0.862 0.928 0.947 0.947 Compound_1349 O=C(c1cc2c(n1C)c1ccccc1n(c2=O)C)Nc1ccc2c(c1)OCO2 0.741 0.699 1.001 0.627 0.651 0.618 0.862 0.809 0.536 0.036 0.554 Compound_1350 CSc1nnc2c(n1)OC(c1ccsc1)N(c1c2cccc1)C(=O)C 0.655 0.658 0.828 0.692 0.484 0.668 0.355 0.726 0.65 0.325 0.259 Compound_1351 O=C(c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1)OCc1ccccc1 0.617 0.552 0.121 0.468 0.514 0.631 0.996 0.606 0.444 0.037 0.938 Compound_1352 COC(=O)c1c(scc1c1ccncc1)NC(=O)c1ccoc1C 0.426 0.741 0.987 0.48 0.427 0.621 0.699 0.386 0.689 0.047 0.478 Compound_1353 O=C(c1sc2c(c1)c1c(n2C)cccc1)OCc1c(C)noc1C 0.597 0.749 0.978 0.513 0.728 0.67 0.996 0.624 0.481 0.414 0.746 Compound_1354 COc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCN2CCN(CC2)C)c(=O)c2c1ccc(c2)OC 0.768 0.694 0.272 0.64 0.911 0.928 0.103 0.47 0.511 0.66 0.319 Compound_1355 O=C(c1ccc(c(c1)N(=O)=O)SCC1CCCO1)NNC(=O)c1ccc(c(c1)N(=O)=O)Cl 0.616 0.576 0.437 0.496 0.761 0.656 0.897 0.946 0.416 0.997 0.654 Compound_1356 CCCCn1c2nc3ccccc3nc2c(c1NC(=O)CC)C#N 0.555 0.532 0.047 0.431 0.535 0.706 0.181 0.327 0.304 0.047 0.365 Compound_1357 O=C(c1cc2c(n1Cc1ccccc1)ccs2)N1CCc2c1cccc2 0.658 0.664 0.46 0.55 0.661 0.735 0.991 0.441 0.85 0.517 0.333 Compound_1358 OC(=O)c1cc(nc2c1cccc2)c1ccco1 0.359 0.605 0.78 0.56 0.32 0.441 0.991 0.424 0.456 0.098 0.731 Compound_1359 O=C(c1cc2c(o1)cccc2)Nc1sc2c(c1C(=O)N)CCC2 0.616 0.578 0.905 0.471 0.169 0.563 0.989 0.698 0.461 0.357 0.675 Compound_1360 O=C1N(CCCc2nc3ccccc3c(=O)n2CCCn2cncc2)C(=O)c2c1cccc2 0.592 0.628 0.866 0.56 0.378 0.775 0.108 0.486 0.541 0.09 0.087 Compound_1361 CSc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)F 0.32 0.305 0.79 0.519 0.402 0.532 0.51 0.215 0.126 0.945 0.55 Compound_1362 CC1CCN(CC1)Cc1c(O)c(Cl)cc2c1oc(=O)cc2C 0.333 0.631 0.111 0.312 0.518 0.678 0.638 0.525 0.648 0.384 0.201 Compound_1363 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCN(C)C 0.692 0.726 0.064 0.652 0.943 0.965 0.19 0.458 0.429 0.385 0.234 Compound_1364 Brc1ccc(s1)C(=O)Nc1scc(n1)c1ccccn1 0.602 0.662 0.896 0.587 0.598 0.682 0.105 0.968 0.529 0.143 0.178 Compound_1365 CCN(Cc1ccccn1)Cc1ccc(cc1)C(=O)N1CCc2c(C1)cc(cc2)O 0.163 0.68 0.614 0.299 0.443 0.96 0.263 0.58 0.482 0.076 0.271 Compound_1366 CCOC(=O)Nc1on[n+](c1)N1CCOCC1 0.069 0.47 0.224 0.491 0.102 0.336 0.004 0.142 0.173 0.617 0.24 Compound_1367 CC=CCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1 0.61 0.572 0.082 0.402 0.403 0.623 0.97 0.566 0.511 0.066 0.95 Compound_1368 ClC1=CCC2C(C1)C(=O)N(C2=O)CCCCCCN1C(=O)C2C(C1=O)CC(=CC2)Cl 0.527 0.583 0.588 0.739 0.649 0.7 0.585 0.973 0.591 0.995 0.758 Compound_1369 COc1ccc2c(c1)nc1c(c2)c(nn1C(=O)Cc1ccc(cc1)Cl)N 0.297 0.712 0.997 0.591 0.787 0.761 0.896 0.652 0.788 0.016 0.427 Compound_1370 O=C(Nc1noc(c1)C)CSc1cn(c2c1cccc2)CCNC(=O)c1ccc(cc1)Cl 0.475 0.489 0.861 0.37 0.675 0.728 0.945 0.805 0.367 0.078 0.5 Compound_1371 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCN1CCCCC1 0.713 0.681 0.105 0.675 0.703 0.572 0.548 0.516 0.379 0.073 0.246 Compound_1372 O=C(N(Cc1ccccc1)Cc1ccccc1)CN(S(=O)(=O)N(C)C)c1ccccc1 0.109 0.59 0.161 0.464 0.747 0.878 0.323 0.365 0.335 0.164 0.345 Compound_1373 COc1ccc(cc1NC(=O)c1ocnc1C)Cl 0.352 0.53 0.968 0.658 0.366 0.566 0.057 0.595 0.689 0.588 0.597 Compound_1374 O=C(COC(=O)c1cccc(c1)S(=O)(=O)N1CCc2c(C1)cccc2)NCc1ccco1 0.322 0.55 0.294 0.397 0.06 0.609 0.769 0.3 0.392 0.01 0.2 Compound_1375 COc1cccc2c1nc(s2)Nc1nnc(o1)c1ccc(cc1)F 0.614 0.693 0.994 0.776 0.624 0.659 0.869 0.872 0.632 0.706 0.646 Compound_1376 Fc1ccc2c(c1)OCc1c(C2=Cc2ccc3c(c2)[nH]c(=O)n3C2CC3N(C2)CCOC3)cccc1 0.805 0.606 0.463 0.314 0.679 0.597 0.507 0.249 0.57 0.081 0.144 Compound_1377 O=C(C1COc2c(O1)cccc2)Nc1scc(n1)c1nc2c(s1)cccc2 0.56 0.663 0.983 0.616 0.518 0.738 0.197 0.524 0.402 0.304 0.647 Compound_1378 CCOc1ccc(cc1)CC1SC(=NC1=O)Nc1ccccn1 0.331 0.603 0.525 0.603 0.139 0.54 0.089 0.949 0.356 0.004 0.32 Compound_1379 Brc1ccc2n(c1)c(=O)cc(n2)CSc1nnc(n1C)C1COc2c(O1)cccc2 0.581 0.526 0.482 0.516 0.512 0.617 0.311 0.179 0.418 0.019 0.5 Compound_1380 OC(=O)c1occc1COc1ccc(c(c1)C)C 0.276 0.458 0.319 0.389 0.066 0.105 0.928 0.013 0.61 0.325 0.248 Compound_1381 O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)NC1CC1)CSc1nccn1C 0.622 0.534 0.992 0.684 0.556 0.674 0.128 0.425 0.499 0.633 0.407 Compound_1382 Cc1ccc2c(c1)cc(c(n2)O)c1nc2n(c1NCc1ccco1)cccc2 0.505 0.681 0.496 0.554 0.707 0.649 0.968 0.957 0.301 0.196 0.571 Compound_1383 O=C(c1cccs1)Nc1sc2c(c1C(=O)N)CCCCCC2 0.689 0.561 0.107 0.36 0.295 0.744 0.957 0.603 0.458 0.663 0.758 Compound_1384 O=C(c1ccccc1F)CSc1nnc(o1)c1ccc2c(c1)c(C)c([nH]2)C 0.486 0.577 0.987 0.639 0.741 0.658 0.998 0.596 0.5 0.178 0.719 Compound_1385 N#CC1=C(N)Oc2c(C1c1cc(OC)c3c(c1)OCO3)c(=O)oc(c2)C 0.639 0.83 0.442 0.563 0.452 0.652 0.711 0.244 0.627 0.015 0.676 Compound_1386 CCc1ccc2c(c1)cc(c(n2)O)CN(C(=O)c1ccco1)Cc1ccc2c(c1)OCO2 0.628 0.677 0.881 0.511 0.65 0.64 0.981 0.865 0.334 0.101 0.482 Compound_1387 Oc1ccc(cc1)C1CCc2c(O1)cc(cc2)O 0.248 0.759 0.365 0.619 0.948 0.874 0.803 0.237 0.381 0.421 0.797 Compound_1388 Clc1ccc(cc1)NC(c1c(C)[nH]c2c1ccc(c2)C)c1ccccc1Cl 0.582 0.796 0.986 0.592 0.857 0.743 0.999 0.839 0.671 0.928 0.841 Compound_1389 Fc1ccc(cc1)c1nnc(c2c1cccc2)n1nnc2c1cccc2 0.591 0.577 0.99 0.672 0.696 0.727 0.728 0.27 0.96 0.302 0.411 Compound_1390 O=C(c1ccc(cc1)N)ON1C(C)(C)CC(CC1(C)C)OC(=O)C 0.4 0.693 0.119 0.524 0.093 0.801 0.957 0.281 0.653 0.227 0.816 Compound_1391 N#CC1=C(SCC(=O)c2ccc(cc2C)C)NC(=O)CC1c1ccco1 0.406 0.59 0.091 0.326 0.399 0.575 0.944 0.382 0.421 0.018 0.705 Compound_1392 CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3c(n2Cc2ccccc2)cccc3)C(=O)CC(C1)(C)C 0.598 0.699 0.959 0.489 0.713 0.829 0.994 0.946 0.428 0.436 0.824 Compound_1393 CCOc1cccc2c1oc(=O)c(c2)c1nnc(s1)NCc1ccco1 0.524 0.667 0.979 0.549 0.172 0.594 0.136 0.826 0.367 0.074 0.684 Compound_1394 O=C(c1ccco1)Oc1cccc(c1)c1cnc2c(n1)cccc2 0.222 0.662 0.511 0.663 0.268 0.552 0.956 0.814 0.363 0.112 0.922 Compound_1395 N#CC(=C(Nc1ccc(cc1)Cl)O)c1nc2c([nH]1)cccc2 0.412 0.745 1.0 0.53 0.641 0.733 0.333 0.779 0.418 0.626 0.62 Compound_1396 O=C(Nc1ccc2c(c1)COC2=O)CSc1nnnn1c1ccc(c(c1)C)C 0.614 0.615 0.991 0.569 0.439 0.834 0.999 0.027 0.436 0.08 0.332 Compound_1397 Cc1nc2cc(nn2c(c1Cl)O)c1ccsc1n1c(C)ccc1C 0.687 0.579 0.12 0.588 0.684 0.652 0.839 0.94 0.588 0.953 0.247 Compound_1398 COc1ccc(cc1)CNC(=O)c1noc(c1)c1cccs1 0.493 0.525 0.947 0.559 0.624 0.74 0.164 0.763 0.716 0.054 0.467 Compound_1399 O=C(c1cccs1)Nc1ccc2c(c1)nc(o2)c1ccc2c(c1)cccc2 0.413 0.719 0.999 0.792 0.773 0.664 0.957 0.992 0.535 0.723 0.699 Compound_1400 Brc1cncc(c1)C(=O)NN=Cc1cccc(c1)Oc1ccc(cc1N(=O)=O)N(=O)=O 0.547 0.675 0.957 0.529 0.665 0.679 0.882 0.829 0.408 0.843 0.784 Compound_1401 COCCNC(=O)c1cnc2c(c1O)cc(cc2)S(=O)(=O)N(c1ccccc1)CC 0.556 0.619 0.058 0.49 0.363 0.492 0.878 0.616 0.234 0.087 0.224 Compound_1402 Brc1ccc(cc1)C(=O)c1sc2c(c1N)c(sn2)C 0.505 0.719 0.966 0.587 0.537 0.657 0.962 0.909 0.511 0.659 0.506 Compound_1403 Cc1ccc(cc1)S(=O)(=O)NCCn1c(C)cc2c1cccc2 0.278 0.59 0.905 0.285 0.566 0.645 0.704 0.971 0.358 0.004 0.173 Compound_1404 O=C(NCc1ccco1)CSc1nnc(s1)Nc1ccc(cc1)C 0.308 0.573 0.673 0.383 0.536 0.68 0.158 0.511 0.39 0.015 0.291 Compound_1405 CCN1CCc2c(C1)sc(n2)NC(=O)Cc1ccc2c(c1)OCCO2 0.471 0.517 0.371 0.238 0.105 0.755 0.152 0.127 0.281 0.191 0.265 Compound_1406 Oc1ccc2c(c1C=Nn1c(C)nc3c(c1=O)cccc3)c1CCCCc1o2 0.582 0.572 0.26 0.447 0.863 0.745 0.979 0.73 0.431 0.133 0.07 Compound_1407 O=C(c1ccco1)OCc1nc2ccccc2n(=O)c1C(=O)C 0.313 0.687 0.311 0.507 0.522 0.446 0.919 0.8 0.462 0.106 0.835 Compound_1408 CCCCOC(=O)c1c(F)c(F)c(c(c1F)F)O 0.852 0.231 0.964 0.719 0.868 0.689 0.907 0.818 0.44 0.491 0.288 Compound_1409 CCCc1cc(n2cncc2)n2c(c1C#N)nc1c2cccc1 0.441 0.606 0.213 0.573 0.492 0.611 0.784 0.491 0.543 0.429 0.786 Compound_1410 NC(=O)c1ccccc1OCC1ON=C(C1)c1ccccc1 0.633 0.6 0.139 0.3 0.329 0.822 0.941 0.051 0.421 0.068 0.792 Compound_1411 Fc1ccccc1Oc1nnc(c2c1cccc2)C 0.806 0.661 0.97 0.639 0.583 0.72 0.937 0.971 0.862 0.732 0.836 Compound_1412 O=S(=O)(c1cccc(c1)C(F)(F)F)Nc1ccc(cc1)Oc1ccccc1 0.217 0.311 0.679 0.453 0.787 0.941 0.48 0.971 0.194 0.377 0.604 Compound_1413 CC1Cc2c3cc(F)c(cc3[nH]c2C2(N1)C(=O)Nc1c2cc(Cl)cc1)Cl 0.711 0.595 0.974 0.499 0.726 0.677 0.853 0.723 0.445 0.462 0.714 Compound_1414 CC(CCN1Cc2cc(CC(C)C)c(cc2NC(C1=O)CC(C)C)N)C 0.389 0.635 0.978 0.284 0.227 0.4 0.108 0.121 0.36 0.116 0.182 Compound_1415 CC(CCN1Cc2cc(C=C(C)C)c(cc2NC(C1=O)CC(C)C)N)C 0.445 0.691 0.973 0.298 0.197 0.356 0.046 0.445 0.362 0.238 0.256 Compound_1416 COc1ccc(cc1)c1nnc(o1)SCC(=C(C(=N)C)C#N)O 0.569 0.539 0.746 0.725 0.612 0.635 0.716 0.984 0.488 0.047 0.834 Compound_1417 O=C(CSc1nc2scc(c2c(=O)n1c1ccccc1)c1ccco1)NCC1CCCO1 0.635 0.506 0.277 0.521 0.516 0.675 0.011 0.733 0.395 0.395 0.218 Compound_1418 O=C(c1cc2ccccc2c(=O)o1)NCc1ccco1 0.289 0.674 0.973 0.374 0.021 0.457 0.106 0.969 0.24 0.118 0.466 Compound_1419 CCCNC(=O)c1ccc(s1)c1nc2c(s1)cccc2 0.517 0.538 0.929 0.59 0.428 0.828 0.122 0.94 0.495 0.18 0.361 Compound_1420 CCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1 0.59 0.532 0.148 0.44 0.403 0.623 0.97 0.265 0.303 0.016 0.946 Compound_1421 Oc1ccc(c(c1)O)C=Nc1ccc(cc1)N1CCOCC1 0.505 0.663 0.899 0.633 0.788 0.879 0.028 0.612 0.387 0.029 0.548 Compound_1422 O=C(NCc1ccco1)COC(=O)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)C 0.153 0.388 0.285 0.446 0.134 0.678 0.447 0.245 0.382 0.05 0.186 Compound_1423 N#Cc1cc2c(n(c1=O)c1ccc(cc1)C)nc1n(c2=O)cccc1C 0.656 0.722 0.452 0.486 0.29 0.709 0.111 0.253 0.637 0.018 0.319 Compound_1424 COc1cc(ccc1OC(=O)C)C=C1SC2N(C1=O)NC(N2)c1ccncc1 0.541 0.659 0.057 0.541 0.426 0.643 0.435 0.11 0.423 0.031 0.435 Compound_1425 COC(=O)C(CC1(C)CC2CCC1CC2C(CCNC(=O)CCC(C)C)(C)C)N 0.113 0.365 0.049 0.233 0.089 0.179 0.232 0.029 0.341 0.007 0.048 Compound_1426 O=C(NC(=O)NCc1ccco1)CSc1cc(C)c2c(n1)c(C)ccc2 0.285 0.403 0.9 0.391 0.602 0.728 0.505 0.53 0.395 0.02 0.442 Compound_1427 O=C(c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1)OCC1CCCO1 0.674 0.577 0.024 0.45 0.54 0.64 0.91 0.332 0.416 0.638 0.861 Compound_1428 CCc1nnc2n1nc(s2)c1ccc(cc1)NC(=O)c1ccc2c(c1)OCCO2 0.529 0.646 0.936 0.815 0.455 0.77 0.942 0.923 0.404 0.037 0.39 Compound_1429 CCCCOC(=O)c1cc(C)c(c(c1)C)O 0.505 0.297 0.746 0.651 0.646 0.942 0.131 0.122 0.773 0.158 0.418 Compound_1430 O=C(c1noc(c1)c1ccco1)N1CCc2c(C1)cccc2 0.209 0.68 0.848 0.674 0.132 0.524 0.567 0.891 0.472 0.003 0.158 Compound_1431 COc1cc(ccc1NC(=O)c1ccco1)NC(=O)CSc1nc2ccccc2c(=O)n1C 0.469 0.529 0.964 0.644 0.347 0.549 0.885 0.352 0.402 0.079 0.556 Compound_1432 N#Cc1cc2cc(CC)ccc2nc1SCC(=O)N1CC(=O)Nc2c1cccc2 0.505 0.463 0.972 0.699 0.796 0.607 0.583 0.789 0.463 0.212 0.781 Compound_1433 O=C1N=C(SC1=C1C(=O)N(c2c1cccc2)C)Nc1cccc(c1C)C 0.486 0.676 0.622 0.453 0.108 0.412 0.982 0.777 0.412 0.966 0.425 Compound_1434 COc1ccc(cc1)OCCC(=O)OCC(=O)NCc1ccco1 0.054 0.583 0.282 0.53 0.035 0.361 0.218 0.673 0.401 0.079 0.089 Compound_1435 COc1ccc(cc1)NC1=NC(=O)SC1=Cc1ccc(cc1)N(C)C 0.445 0.746 0.927 0.637 0.487 0.889 0.876 0.887 0.534 0.908 0.347 Compound_1436 Brc1cnc2n(c1)nc(c2)C(=O)N1CCN(CC1)C(=O)c1cccc(c1)F 0.352 0.664 0.24 0.543 0.507 0.669 0.203 0.769 0.382 0.211 0.112 Compound_1437 N#Cc1c(cc(c(c1N)C#N)c1ccco1)c1ccccc1 0.292 0.697 0.929 0.809 0.606 0.666 0.997 0.553 0.549 0.937 0.953 Compound_1438 O=C(Nc1noc(c1)C)CSc1nc2CC(Sc2c(=O)n1CCc1ccccc1)C 0.505 0.512 0.388 0.368 0.613 0.746 0.153 0.205 0.38 0.03 0.313 Compound_1439 O=C(Cc1cccs1)Nc1nnc(s1)SCC(=O)N1C(C)Cc2c1cccc2 0.542 0.512 0.357 0.398 0.59 0.672 0.889 0.376 0.418 0.337 0.295 Compound_1440 N#Cc1ccc(cc1)OCC(=O)c1[nH]c(c(c1C)C(=O)C)C 0.539 0.567 0.57 0.624 0.5 0.633 0.623 0.914 0.705 0.016 0.932 Compound_1441 CCCCOC(=O)c1cc(I)c(c(c1)I)O 0.738 0.23 0.92 0.692 0.945 0.359 0.928 0.406 0.511 0.491 0.623 Compound_1442 CCCCCCc1cc2cc(c3nnc(o3)c3ccccc3)c(=O)oc2cc1O 0.735 0.702 0.611 0.663 0.713 0.694 0.932 0.951 0.678 0.514 0.537 Compound_1443 CCOCCCNC(=O)c1cnc2c(c1O)cc(cc2)S(=O)(=O)Nc1cccc(c1)OC 0.473 0.719 0.262 0.458 0.391 0.535 0.86 0.53 0.277 0.331 0.27 Compound_1444 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCCN1CCN(CC1)C 0.747 0.714 0.104 0.467 0.925 0.978 0.307 0.637 0.552 0.506 0.364 Compound_1445 Cc1sc2c(c1C)c(ncn2)NCc1ccco1 0.375 0.644 0.986 0.514 0.361 0.636 0.041 0.655 0.396 0.043 0.167 Compound_1446 COc1cc(ccc1NC(=O)c1ccco1)NC(=O)CSc1nc2ccccc2c(=O)n1CC 0.475 0.522 0.954 0.648 0.332 0.55 0.789 0.318 0.402 0.385 0.5 Compound_1447 COc1ccc(cc1N)NC(=O)c1ccco1 0.298 0.511 0.992 0.677 0.08 0.418 0.3 0.699 0.444 0.122 0.566 Compound_1448 Cc1onc(c1)C(=O)OCC(=O)c1ccc(s1)Br 0.56 0.6 0.585 0.473 0.603 0.68 0.987 0.399 0.519 0.849 0.86 Compound_1449 O=C(c1nn2c(c1Br)nc(cc2C(F)(F)F)c1cccs1)NCc1ccco1 0.623 0.545 0.429 0.426 0.698 0.658 0.98 0.973 0.365 0.045 0.459 Compound_1450 O=C(OC(C(=O)N(C)C)C)COc1ccc(cc1C)Cl 0.014 0.491 0.888 0.688 0.025 0.105 0.232 0.968 0.389 0.312 0.077 Compound_1451 Fc1ccc2c(c1)OCc1c(C2=Cc2ccc3c(c2)NC(=O)C23CCN(=O)(CC2)C)cccc1 0.659 0.737 0.313 0.627 0.846 0.863 0.935 0.893 0.849 0.123 0.421 Compound_1452 N#CC(=C(CSc1nnc(o1)COc1ccccc1Cl)O)C(=N)C 0.604 0.574 0.734 0.685 0.61 0.6 0.378 0.88 0.454 0.132 0.783 Compound_1453 O=C(Cc1cccs1)Nc1nnc(s1)COc1ccccc1 0.381 0.587 0.544 0.467 0.269 0.758 0.726 0.529 0.415 0.03 0.348 Compound_1454 N#Cc1nc(oc1NCc1cccnc1)c1ccc(cc1)OCc1ccc(cc1)Cl 0.354 0.631 0.99 0.735 0.631 0.621 0.936 0.821 0.491 0.718 0.854 Compound_1455 Cc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)NCc1ccc2c(c1)OCO2 0.43 0.528 0.954 0.397 0.207 0.598 0.201 0.458 0.401 0.18 0.298 Compound_1456 O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1Cc1ccco1)c1cnccn1 0.442 0.569 0.648 0.489 0.581 0.656 0.996 0.147 0.426 0.035 0.2 Compound_1457 NC(=O)C1(CCN(CC1)c1scc(n1)c1ccc(cc1)Br)N1CCCCC1 0.217 0.585 0.011 0.396 0.476 0.668 0.014 0.307 0.415 0.038 0.055 Compound_1458 CCCn1nc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c2c(c1=O)cccc2 0.647 0.674 0.536 0.445 0.163 0.564 0.495 0.794 0.406 0.167 0.141 Compound_1459 COC(=O)C(CC1(C)CC2CCC1CC2C(CCNC(=O)CCC(C)C)(C)C)NC(=O)OCc1ccccc1 0.139 0.483 0.328 0.262 0.308 0.776 0.675 0.474 0.386 0.036 0.247 Compound_1460 COc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCCN2CCCCC2)c(=O)c2c1ccc(c2)OC 0.765 0.671 0.11 0.513 0.937 0.984 0.586 0.732 0.458 0.04 0.285 Compound_1461 COC(=O)c1ccc(o1)CSc1nc(O)c2c(n1)n(nc2)c1ccc(c(c1)C)C 0.52 0.654 0.61 0.499 0.677 0.65 0.999 0.072 0.642 0.094 0.7 Compound_1462 O=C(COC(=O)c1c(C)onc1c1c(F)cccc1Cl)NCc1ccco1 0.224 0.636 0.952 0.382 0.524 0.603 0.696 0.609 0.379 0.808 0.415 Compound_1463 Cc1c(C)cccc1N1CCN(CC1)c1nc2ccccc2n2c1nnc2 0.148 0.71 0.108 0.47 0.4 0.73 0.971 0.772 0.4 0.005 0.056 Compound_1464 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCCN(C)C 0.755 0.737 0.016 0.49 0.709 0.668 0.367 0.638 0.392 0.245 0.316 Compound_1465 CCCCOC(=O)c1cc(Br)c(c(c1)Br)O 0.879 0.216 0.92 0.692 0.683 0.795 0.957 0.406 0.459 0.803 0.657 Compound_1466 CCN(CCCOc1ccc(cc1)n1c2c3ccc(cc3C(=O)c2c2c(c1=O)cc(cc2)OC)OC)CC 0.694 0.737 0.049 0.531 0.701 0.735 0.556 0.904 0.439 0.463 0.727 Compound_1467 CN(CC(=O)N1CCC2(CC1)C(=O)Nc1c2ccc(c1)C=C1c2ccccc2COc2c1ccc(c2)F)C 0.674 0.756 0.136 0.425 0.845 0.731 0.964 0.832 0.492 0.161 0.219 Compound_1468 O=C(Nc1sc2c(c1C(=O)Nc1ccccc1)CCCC2)CSc1n[nH]c(n1)c1ccco1 0.611 0.596 0.935 0.719 0.673 0.655 0.961 0.417 0.444 0.118 0.534 Compound_1469 O=C(CN(S(=O)(=O)C)c1ccc2c(c1)OCO2)NCc1ccco1 0.253 0.543 0.539 0.365 0.199 0.531 0.006 0.58 0.378 0.178 0.413 Compound_1470 CCOC(=O)C1=C(C)SC(=CN(C)C)C1=O 0.622 0.582 0.06 0.367 0.354 0.282 0.204 0.707 0.459 0.724 0.905 Compound_1471 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCCN1CCCC1 0.763 0.661 0.11 0.523 0.752 0.661 0.669 0.769 0.475 0.04 0.44 Compound_1472 CCOC(=O)C1=C(O)C(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccc(c(c2)C)C)N=C1C 0.576 0.606 0.917 0.644 0.202 0.369 0.372 0.357 0.418 0.396 0.793 Compound_1473 O=C(c1cc2ccccc2oc1=O)Nc1ccc(cc1)n1nncc1c1ccco1 0.505 0.802 0.999 0.717 0.442 0.561 0.977 0.522 0.53 0.452 0.364 Compound_1474 COCCCNC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)Cc1ccc2c(c1)OCO2 0.384 0.518 0.838 0.358 0.07 0.816 0.599 0.686 0.387 0.309 0.49 Compound_1475 COC(=O)c1oc2c(c1NC(=O)CCCN1C(=O)c3c(C1=O)cccc3)cc(cc2)Br 0.414 0.627 0.62 0.48 0.64 0.645 0.943 0.324 0.419 0.242 0.193 Compound_1476 CCOC(=O)c1c(Nc2sc(c(n2)C)C(=O)NC)sc(c1C)C 0.531 0.62 0.971 0.426 0.116 0.699 0.023 0.182 0.505 0.109 0.718 Compound_1477 Cc1ccc(cc1)c1nnc2n1N=C(CS2)c1ccc(cc1)Br 0.584 0.599 0.981 0.777 0.529 0.662 0.906 0.783 0.519 0.066 0.326 Compound_1478 COC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccco1 0.439 0.648 0.361 0.6 0.585 0.654 0.98 0.489 0.269 0.009 0.803 Compound_1479 CCn1c(SCC(=O)c2ccc(o2)CNC(=O)C)nnc1c1cccs1 0.447 0.524 0.383 0.408 0.568 0.657 0.122 0.329 0.454 0.053 0.461 Compound_1480 O=C(N1CCN(CC1)c1ccc(cc1)C(F)(F)F)CCCCCn1c(=S)[nH]c2c(c1=O)cccc2 0.422 0.382 0.881 0.559 0.52 0.513 0.469 0.796 0.427 0.347 0.247 Compound_1481 Cc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)N1CCC2(CC1)OCCO2 0.196 0.617 0.24 0.41 0.125 0.52 0.33 0.532 0.405 0.607 0.143 Compound_1482 Clc1ccc(c(c1)N=CC1=C(O)CC(CC1=O)c1ccco1)O 0.505 0.663 0.634 0.618 0.529 0.691 0.6 0.823 0.503 0.826 0.942 Compound_1483 CCc1nnc2n1N=C(CS2)c1ccc(o1)c1cc(Cl)ccc1Cl 0.505 0.616 0.983 0.628 0.564 0.707 0.804 0.816 0.583 0.055 0.476 Compound_1484 C=CCn1c(=O)c(C#N)cc2c1nc1ccccn1c2=O 0.541 0.561 0.817 0.545 0.222 0.7 0.006 0.756 0.384 0.051 0.541 Compound_1485 N#CC(=C(CSc1nnc(o1)c1ccc(cc1)OC(F)F)O)C(=N)C 0.594 0.539 0.746 0.744 0.72 0.641 0.561 0.933 0.427 0.027 0.835 Compound_1486 O=C(Nc1nccs1)CSc1n[nH]c(n1)c1ccc(cc1)S(=O)(=O)N1CCCCC1 0.491 0.498 0.143 0.44 0.542 0.671 0.586 0.129 0.343 0.026 0.162 Compound_1487 COC(=O)c1cc2c(n1CC(=O)Nc1ccc(cc1)N(C)C)scc2 0.592 0.664 1.0 0.622 0.313 0.741 0.209 0.724 0.885 0.046 0.341 Compound_1488 CCOc1ccc(cc1)NC(=O)c1cc2c(o1)nc1c(c2)ccc(c1)OC 0.39 0.744 0.998 0.808 0.749 0.661 0.983 0.858 0.388 0.149 0.933 Compound_1489 Brc1ccc2c(c1)c(cc(n2)c1ccco1)C(=O)O 0.435 0.549 0.858 0.507 0.662 0.652 0.996 0.102 0.444 0.283 0.736 Compound_1490 O=C(CN1C(=O)NC2(C1=O)CCCCCCC2)Nc1cccc(c1)C(=O)C 0.298 0.508 0.918 0.529 0.167 0.319 0.451 0.653 0.39 0.126 0.412 Compound_1491 Cc1nc2c(o1)c(ccc2)C(=O)NCc1ccccc1 0.228 0.603 0.99 0.488 0.511 0.6 0.507 0.598 0.561 0.033 0.72 Compound_1492 COC(=O)c1ccc(o1)CSc1nc(C)nc2c1c(C)c(s2)C 0.465 0.676 0.853 0.532 0.411 0.644 0.96 0.434 0.698 0.042 0.561 Compound_1493 COc1cc(C)c(cc1C)S(=O)(=O)NCc1ccc2c(c1)OCO2 0.425 0.666 0.764 0.321 0.133 0.709 0.075 0.089 0.26 0.564 0.413 Compound_1494 CC1CCCN(C1)C(=O)COC(=O)c1[nH]nc2c1cccc2 0.261 0.726 0.851 0.49 0.515 0.663 0.168 0.063 0.376 0.171 0.302 Compound_1495 O=C(C1COc2c(O1)cccc2)Nc1sc2c(c1C(=O)NC1CCS(=O)(=O)C1)CCCC2 0.634 0.587 0.098 0.364 0.277 0.656 0.391 0.789 0.417 0.387 0.31 Compound_1496 CSc1cccc(c1)NC(=O)CN(S(=O)(=O)N(C)C)c1ccccc1 0.235 0.523 0.779 0.611 0.5 0.661 0.072 0.22 0.274 0.232 0.263 Compound_1497 COc1cc(ccc1OCCCOc1ccccc1C)C=C1C(=O)N=c2n(C1=N)ccs2 0.553 0.669 0.918 0.64 0.118 0.838 0.063 0.96 0.473 0.125 0.564 Compound_1498 C=CCn1c(SCC(=O)NC2CCCCC2)nnc1C(NC(=O)c1cccs1)C 0.581 0.558 0.293 0.53 0.173 0.782 0.072 0.976 0.385 0.722 0.252 Compound_1499 O=C(c1ccco1)Nc1cnc2c(c1)cccc2 0.288 0.686 0.973 0.676 0.067 0.411 0.042 0.962 0.487 0.493 0.836 Compound_1500 Cc1ccc(cc1)CNc1nc2ccccc2n2c1nnn2 0.254 0.67 0.071 0.423 0.579 0.818 0.884 0.02 0.343 0.033 0.317 Compound_1501 O=C(NC(c1ccccc1)C)CCSc1nc(cc(n1)C(F)(F)F)c1ccc2c(c1)OCO2 0.378 0.642 0.796 0.481 0.629 0.727 0.626 0.962 0.335 0.037 0.576 Compound_1502 OCCNS(=O)(=O)c1cc(ccc1C)c1nnc(c2c1cccc2)OC 0.163 0.539 0.904 0.395 0.349 0.748 0.485 0.779 0.344 0.048 0.209 Compound_1503 O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1c(C)cc(cc1C)C)CSc1nnnn1Cc1ccccc1 0.674 0.566 1.001 0.602 0.589 0.683 0.996 0.681 0.502 0.902 0.262 Compound_1504 CCOC(=O)c1c(C)oc2c1c(C(c1cccnc1)N1CCCCC1)c(O)c1c2cccc1 0.505 0.665 0.232 0.271 0.303 0.711 0.992 0.155 0.538 0.535 0.832 Compound_1505 COc1cc(OC)ccc1C(=O)CSc1nnc(n1N)C1CCCCC1 0.592 0.581 0.265 0.491 0.514 0.766 0.897 0.083 0.566 0.184 0.605 Compound_1506 CC1CCC2(CC1)NC(=O)N(C2=O)CC(=O)c1[nH]ccc1 0.24 0.558 0.096 0.285 0.272 0.673 0.002 0.061 0.297 0.049 0.435 Compound_1507 Fc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)NC(=O)N(C1=O)c1ccccc1 0.567 0.624 0.1 0.486 0.913 0.868 0.592 0.767 0.388 0.055 0.463 Compound_1508 Fc1ccc(cc1)Nc1nc(NN=Cc2ccc(c(c2)N(=O)=O)Cl)nc(n1)N(C)C 0.904 0.664 0.886 0.542 0.744 0.71 0.926 0.839 0.43 0.672 0.873 Compound_1509 COc1ccc(cc1)c1nc(SCC(=O)NCc2ccco2)c(c(c1)c1cccs1)C#N 0.444 0.407 0.894 0.623 0.69 0.693 0.954 0.964 0.39 0.006 0.613 Compound_1510 Cc1cc(C)c2c(c1)c(cc(n2)c1ccccn1)C(=O)NCc1ccco1 0.308 0.604 0.992 0.434 0.434 0.586 0.981 0.895 0.402 0.01 0.653 Compound_1511 O=C(Nc1nccs1)CSc1nc2CCSc2c(=O)n1c1ccc(cc1)Br 0.505 0.53 0.188 0.396 0.488 0.653 0.266 0.299 0.401 0.035 0.32 Compound_1512 COC(=O)Oc1c(Br)c(=O)oc2c1cccc2 0.561 0.569 0.954 0.663 0.737 0.583 0.419 0.723 0.889 0.762 0.347 Compound_1513 CSc1ccc(cc1)S(=O)(=O)Nc1c(C)cccc1C 0.152 0.353 0.169 0.353 0.265 0.536 0.747 0.014 0.278 0.956 0.374 Compound_1514 CC(C(=O)OCC(=O)Nc1ccc(cc1)Br)NC(=O)C 0.578 0.41 0.915 0.677 0.247 0.65 0.042 0.331 0.407 0.223 0.13 Compound_1515 CCC(=O)Nc1nonc1c1nc2c(n1N(C(=O)CC)C(=O)CC)cccc2 0.375 0.449 0.739 0.468 0.625 0.604 0.115 0.252 0.189 0.924 0.594 Compound_1516 Oc1ccc(cc1)C1C2C3CCC(C2Sc2c1sc(n2)O)C3 0.593 0.555 0.404 0.598 0.697 0.652 0.469 0.624 0.524 0.867 0.658 Compound_1517 O=C(C(c1ccccc1)Cl)Nc1ccc(cc1)N1CCCC1 0.492 0.589 0.81 0.606 0.866 0.746 0.975 0.967 0.564 0.715 0.552 Compound_1518 CCOC(=O)c1c(NC(=O)CSc2nnc(n2C)CNC(=O)c2ccco2)sc2c1CCC2 0.616 0.624 0.587 0.429 0.575 0.653 0.237 0.072 0.408 0.083 0.624 Compound_1519 COc1ccc(cc1)C=CC(=C1C(=O)N(C)C2(CC1c1ccccc1O2)C)O 0.613 0.732 0.111 0.74 0.111 0.932 0.889 0.966 0.418 0.761 0.587 Compound_1520 COc1cc(OC)nc(n1)NC(=O)C(C)C 0.206 0.232 0.741 0.357 0.139 0.338 0.026 0.037 0.244 0.113 0.154 Compound_1521 C=CCNc1nc(nc2c1cccc2)c1cccc(c1O)OC 0.245 0.6 0.906 0.685 0.864 0.615 0.456 0.936 0.34 0.122 0.67 Compound_1522 COc1ccc(cc1NC(=O)c1oc(nc1C)C)Cl 0.455 0.572 0.974 0.751 0.438 0.567 0.278 0.729 0.689 0.642 0.636 Compound_1523 O=c1c2ccccc2[nH]c2=NCCCCn12 0.512 0.504 0.099 0.448 0.373 0.181 0.043 0.205 0.761 0.182 0.106 Compound_1524 CSc1ncc2c(n1)c1cc(C)ccc1SC2 0.378 0.548 0.941 0.61 0.588 0.644 0.221 0.524 0.664 0.572 0.5 Compound_1525 C1CCC(CC1)c1nn2c(s1)nnc2c1[nH]nc2c1CCC2 0.582 0.518 0.195 0.443 0.683 0.652 0.762 0.325 0.427 0.415 0.149 Compound_1526 O=C(CNC(=O)c1ccc(s1)C)OCC(=O)c1c(N)n(C)c(=O)n(c1=O)C 0.521 0.443 0.179 0.388 0.144 0.421 0.024 0.136 0.402 0.063 0.435 Compound_1527 COc1ccc2c(c1)ccc(c2)CCC(=O)C 0.4 0.864 0.677 0.763 0.35 0.898 0.87 0.933 0.95 0.605 0.672 Compound_1528 COc1ccc(cc1Cn1nc(cc1C)C)C=C1CCc2c(C1=O)ccc(c2)OC 0.738 0.746 0.86 0.648 0.81 0.913 0.74 0.915 0.818 0.412 0.717 Compound_1529 O=C(N1CCCc2c1cccc2)c1noc(c1)c1ccco1 0.386 0.661 0.627 0.64 0.178 0.543 0.339 0.859 0.543 0.003 0.291 Compound_1530 CCCCSc1n[nH]c2c(n1)nc1c2cccc1 0.443 0.557 0.438 0.561 0.685 0.732 0.713 0.372 0.778 0.324 0.513 Compound_1531 CCn1c(SCC(=O)Nc2ccc3c(c2)c2ccccc2n3CC)nnc1c1cnccn1 0.599 0.632 0.917 0.571 0.609 0.647 0.993 0.146 0.394 0.105 0.243 Compound_1532 CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1ccc(o1)Cn1ncc(c1)Br 0.644 0.649 0.06 0.382 0.646 0.648 0.259 0.932 0.527 0.057 0.354 Compound_1533 CCc1nnc(s1)NC(=O)C1Cc2ccccc2CN1S(=O)(=O)c1cccs1 0.435 0.506 0.207 0.317 0.446 0.64 0.513 0.117 0.386 0.029 0.117 Compound_1534 Nc1nc(CSc2nc3ccccc3c(=O)n2C)nc(n1)Nc1ccccc1C 0.649 0.577 0.969 0.469 0.713 0.561 0.484 0.831 0.474 0.002 0.517 Compound_1535 Fc1ccc(cc1F)NCc1cccnc1 0.584 0.613 0.942 0.509 0.141 0.332 0.121 0.981 0.713 0.249 0.311 Compound_1536 Clc1ccc(cc1)SC(=NS(=O)(=O)c1ccccc1)c1ccccc1 0.446 0.588 0.923 0.707 0.704 0.922 0.563 0.327 0.346 0.989 0.473 Compound_1537 COc1c(cccc1OC)C=C1N=C(OC1=O)c1c(C)onc1c1ccccc1 0.615 0.72 0.958 0.714 0.802 0.686 0.992 0.661 0.639 0.588 0.739 Compound_1538 Cc1cccc(c1)n1c(SCc2cc(=O)n3c(n2)scc3)nc2c1cccc2 0.483 0.486 0.05 0.434 0.416 0.828 0.351 0.054 0.536 0.008 0.423 Compound_1539 COc1ccc(cc1)c1cc(n2c(n1)c(cn2)C(=O)NCc1ccco1)C(F)(F)F 0.384 0.661 0.416 0.536 0.654 0.665 0.849 0.93 0.328 0.006 0.672 Compound_1540 NC(=NOC(=O)c1ccc2c(c1)cccc2)Cc1ccc(cc1)N(=O)=O 0.493 0.681 0.891 0.544 0.821 0.919 0.992 0.955 0.667 0.947 0.474 Compound_1541 Brc1ccc2n(c1)c(=O)cc(n2)CSc1nnc(n1C)c1ccoc1C 0.51 0.538 0.405 0.578 0.51 0.681 0.116 0.925 0.57 0.012 0.396 Compound_1542 CCOc1ccccc1C=C1SC2N(C1=O)NC(N2)c1ccco1 0.493 0.573 0.127 0.43 0.381 0.64 0.092 0.54 0.399 0.53 0.63 Compound_1543 COc1cc(ccc1O)C=c1sc(=C(C(=O)N2CCCC2)C#N)n(c1=O)c1ccccc1 0.684 0.67 0.03 0.486 0.781 0.647 0.271 0.148 0.435 0.156 0.356 Compound_1544 CCCc1cc2c(cc1OC(=O)c1ccco1)occ(c2=O)c1ccc2c(c1)OCCO2 0.665 0.736 0.561 0.648 0.284 0.505 0.979 0.793 0.473 0.334 0.495 Compound_1545 O=C(c1c(C)onc1c1ccccc1Cl)NCc1cccnc1 0.306 0.567 0.871 0.582 0.632 0.674 0.426 0.283 0.681 0.031 0.306 Compound_1546 COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1C(N1CCCCC1)C 0.526 0.672 0.47 0.513 0.474 0.689 0.334 0.089 0.447 0.2 0.533 Compound_1547 CCN1C(=Nc2cccc(c2)O)SC(=c2sc3c(n2C)cc(cc3)OC)C1=O 0.468 0.676 0.351 0.605 0.711 0.57 0.157 0.084 0.374 0.843 0.378 Compound_1548 COc1ccc(cc1CNC(=O)C1CCCN(C1)c1nc2c(o1)cccc2)Br 0.319 0.612 0.924 0.448 0.67 0.65 0.194 0.588 0.425 0.046 0.352 Compound_1549 CCOC(=O)c1cc2c(n1CCN(CC)CC)cccc2 0.344 0.843 0.982 0.404 0.248 0.535 0.219 0.091 0.207 0.102 0.491 Compound_1550 C=CCOc1ccc(cc1)CC1C(=O)N(C)C(=O)N(C1=O)C 0.37 0.601 0.834 0.73 0.187 0.603 0.237 0.971 0.331 0.16 0.26 Compound_1551 Cc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c1ccco1)c1c(n2)CCC1 0.641 0.691 0.832 0.738 0.675 0.666 0.995 0.831 0.485 0.012 0.49 Compound_1552 Fc1ccc(cc1)CNc1nc2ccccc2n2c1nnc2 0.214 0.674 0.36 0.551 0.457 0.741 0.925 0.211 0.408 0.028 0.229 Compound_1553 N#Cc1c(SCC(=O)Nc2nccs2)nc2c(c1c1ccco1)CCCC2 0.52 0.49 0.443 0.483 0.548 0.689 0.748 0.909 0.396 0.058 0.588 Compound_1554 O=C(Nc1c(C)nn(c1C)Cc1ccccc1)CSc1nnc(n1C)c1cc(Cl)ccc1O 0.464 0.563 0.943 0.647 0.559 0.74 0.958 0.961 0.58 0.373 0.435 Compound_1555 O=C(c1cn(nc1c1cccnc1)c1ccccc1)OCn1nnc2c(c1=O)cccc2 0.5 0.641 0.97 0.766 0.65 0.401 0.981 0.677 0.725 0.002 0.226 Compound_1556 COc1cc(cc(c1OC)OC)c1nnc(o1)c1ccc(cc1)S(=O)(=O)c1ccccc1 0.255 0.529 0.784 0.771 0.708 0.656 0.882 0.694 0.511 0.68 0.337 Compound_1557 CC(=O)Nc1scc(n1)C=C(Cl)Cl 0.309 0.531 0.437 0.48 0.084 0.677 0.541 0.997 0.38 0.845 0.514 Compound_1558 COc1c(OC)cc(cc1OC)C(=O)OCC(=O)Nc1c(F)c(F)c(c(c1F)F)F 0.42 0.613 0.97 0.571 0.642 0.499 0.709 0.08 0.423 0.367 0.192 Compound_1559 CCOCC(=O)Nc1cccc(c1)C(=O)OCC 0.39 0.466 0.983 0.64 0.024 0.15 0.393 0.044 0.319 0.194 0.118 Compound_1560 Cc1ccc(o1)c1nnn(n1)CC(=O)Nc1ccc2c(c1)nn(n2)c1ccccc1 0.331 0.59 0.996 0.611 0.657 0.656 0.668 0.793 0.713 0.03 0.3 Compound_1561 O=C(c1ccoc1C)Nc1ccccc1NC(=O)c1ccoc1C 0.495 0.63 0.914 0.592 0.341 0.604 0.779 0.479 0.789 0.78 0.883 Compound_1562 N#Cc1c(NC(=O)CSc2nnc(o2)c2ccc(cc2)F)sc(c1C)C 0.491 0.494 0.857 0.655 0.597 0.651 0.858 0.858 0.46 0.082 0.653 Compound_1563 O=C(C1CCC(CC1)N1C(=O)C2C(C1=O)CC=CC2)Nc1ccc(cc1)Cc1ccncc1 0.376 0.649 0.661 0.594 0.206 0.633 0.215 0.213 0.527 0.177 0.449 Compound_1564 Clc1ccc(cc1)CNC(=O)c1noc(c1)c1cccs1 0.452 0.543 0.814 0.479 0.727 0.675 0.083 0.592 0.728 0.197 0.353 Compound_1565 Clc1ccc(cc1)OCCn1c2ccccc2c(c1C)C=Nn1cnnc1 0.436 0.776 0.987 0.582 0.482 0.789 0.98 0.854 0.195 0.159 0.68 Compound_1566 O=C(CN1C(=O)COc2c1cc(C)cc2)NC1CCCc2c1cccc2 0.545 0.621 0.438 0.397 0.219 0.237 0.031 0.55 0.381 0.42 0.112 Compound_1567 N#Cc1c(N(C(=O)C)C(=O)C)c(n(c1C)c1ccccc1)C(=O)c1ccccc1 0.419 0.615 0.237 0.648 0.842 0.575 0.894 0.087 0.831 0.827 0.752 Compound_1568 CCC1(CC)NC(=O)N(C1=O)CC(=O)c1ccc(s1)Cl 0.276 0.502 0.078 0.281 0.253 0.534 0.154 0.84 0.428 0.173 0.398 Compound_1569 O=C(c1ccc(o1)Cn1nc(c(c1C)Br)C)Nc1nc2c(s1)cccc2C 0.54 0.622 0.996 0.642 0.685 0.654 0.897 0.948 0.625 0.196 0.282 Compound_1570 C=CCn1c(=O)[nH]c2c(c1=O)ccc(c2)C(=O)N1CCN(CC1)c1ccc(cc1)C(=O)C 0.469 0.551 0.403 0.476 0.266 0.487 0.322 0.755 0.42 0.022 0.207 Compound_1571 COc1ccc(cc1NC(=O)Cn1nc(C)c2c(c1=O)cccc2)c1nn(C)c(=O)c2c1cccc2 0.76 0.751 0.854 0.664 0.379 0.686 0.767 0.936 0.511 0.25 0.259 Compound_1572 O=C1NC(=O)C(=CNc2ccccc2N)C(=O)N1CCC1=CCCCC1 0.623 0.352 0.161 0.313 0.461 0.523 0.008 0.522 0.404 0.02 0.533 Compound_1573 O=C1CCC(=O)N1c1ccc(cc1)OC(=O)c1ccco1 0.1 0.554 0.196 0.489 0.341 0.466 0.811 0.105 0.44 0.085 0.363 Compound_1574 OCCOCCNc1nc(SC)nc2c1sc1c2c2CCCc2c(n1)c1ccco1 0.656 0.521 0.743 0.442 0.608 0.655 0.941 0.183 0.367 0.213 0.472 Compound_1575 COC(=O)c1sc2c(c1N)ccc(n2)c1ccco1 0.402 0.732 0.996 0.511 0.571 0.647 0.982 0.364 0.543 0.169 0.55 Compound_1576 CCn1c2ccccc2c2c1nc(SCC(=O)Nc1ccc3c(c1)OCO3)nn2 0.505 0.576 1.0 0.647 0.67 0.71 0.986 0.461 0.368 0.024 0.435 Compound_1577 COc1ccc(cc1)n1nc(C(=O)Nc2ccc(c(c2)OC)OC)c2c(c1=O)n(C)c1c2cccc1 0.608 0.753 0.861 0.608 0.739 0.704 0.997 0.342 0.426 0.117 0.511 Compound_1578 CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)CNc1ccc(cc1)OC 0.396 0.629 0.999 0.611 0.391 0.816 0.676 0.006 0.419 0.107 0.594 Compound_1579 COc1cccc(c1)OCc1nnc(n1CCc1ccccc1)SCC(=O)NCc1ccco1 0.438 0.479 0.574 0.456 0.304 0.709 0.969 0.189 0.368 0.136 0.343 Compound_1580 N#CCCS(=O)(=O)c1nnnn1c1ccccc1 0.647 0.342 0.232 0.446 0.385 0.603 0.111 0.665 0.478 0.003 0.519 Compound_1581 OC(Cn1nc(cc1C)C)COc1ccccc1 0.278 0.598 0.157 0.512 0.486 0.36 0.024 0.112 0.547 0.014 0.569 Compound_1582 O=C1N(c2nn(c(n2)N)c2ccccc2)C(=O)C2C1CC=CC2 0.353 0.637 0.753 0.503 0.361 0.678 0.035 0.045 0.759 0.365 0.56 Compound_1583 O=C(c1cn(C)c2c(c1=O)cc(cc2)S(=O)(=O)N1CCCC1)NC1CCCCCC1 0.505 0.529 0.469 0.477 0.323 0.399 0.146 0.3 0.394 0.034 0.162 Compound_1584 CCCn1c(N)c(c2sc(c(n2)c2ccco2)C(=O)c2ccccc2)c(=O)n(c1=O)C 0.623 0.548 0.058 0.63 0.413 0.653 0.351 0.369 0.524 0.009 0.451 Compound_1585 Clc1cc(C)c(c(c1)C)OCCCCN1CCOCC1 0.039 0.459 0.29 0.201 0.054 0.294 0.045 0.361 0.294 0.665 0.307 Compound_1586 COC(=O)C(=CNc1ccc(c2c1cccc2)Cl)c1ncc(cc1Cl)C(F)(F)F 0.533 0.68 0.979 0.59 0.816 0.58 0.997 0.978 0.687 0.484 0.918 Compound_1587 O=C(c1sc2c(c1)COc1c2cccc1)Nc1nc2c(s1)cccc2 0.708 0.737 0.996 0.764 0.516 0.887 0.997 0.987 0.562 0.551 0.583 Compound_1588 CN=C1SC(C(=O)N1C)CC(=O)Nc1ccc(cc1)C(=O)C 0.307 0.444 0.905 0.6 0.113 0.589 0.573 0.152 0.399 0.017 0.145 Compound_1589 O=C(c1cc(ccc1C)S(=O)(=O)N1CCCCC1)Nc1n[nH]cn1 0.333 0.539 0.382 0.297 0.307 0.646 0.005 0.076 0.385 0.042 0.5 Compound_1590 O=C(NC(=O)NCc1ccco1)CSc1scc(n1)c1ccc(cc1)F 0.394 0.458 0.897 0.564 0.616 0.716 0.504 0.88 0.389 0.05 0.533 Compound_1591 C=CCSC1=NC(=CC=Cc2ccco2)C(=O)S1 0.349 0.495 0.888 0.519 0.434 0.747 0.889 0.997 0.245 0.584 0.822 Compound_1592 COC(=O)c1ccc2c(c1)N(Cc1nc(oc1C)c1cccc(c1)C)C(=O)C1N2CCC1 0.626 0.829 0.049 0.578 0.531 0.607 0.585 0.707 0.459 0.627 0.672 Compound_1593 O=C(Nc1nnc(s1)C1CCCCC1)CCC(=O)NCC1CCCO1 0.29 0.5 0.017 0.281 0.116 0.522 0.006 0.475 0.343 0.015 0.241 Compound_1594 Cc1ccc(c(c1)C)NC(=O)C(=Cc1cccc(c1)N(=O)=O)NC(=O)C1CCCCC1 0.525 0.557 0.74 0.484 0.566 0.808 0.738 0.861 0.428 0.985 0.588 Compound_1595 O=C(c1cc(Br)c(c(c1C)C)C)NCc1ccco1 0.433 0.407 0.658 0.404 0.649 0.659 0.051 0.641 0.403 0.247 0.187 Compound_1596 NC(=O)COc1cc(c(cc1C)Cl)S(=O)(=O)Nc1ccc2c(c1)OCO2 0.306 0.498 0.919 0.414 0.53 0.651 0.409 0.121 0.301 0.613 0.436 Compound_1597 CCn1c(SCC(=O)Nc2ccc3c(c2)c2ccccc2n3CC)nnc1c1ccco1 0.513 0.528 0.966 0.712 0.651 0.664 0.996 0.488 0.393 0.483 0.393 Compound_1598 CCOC(=O)CCC(=O)Nc1ccccc1C(=O)N 0.519 0.432 0.328 0.454 0.165 0.155 0.067 0.05 0.31 0.086 0.258 Compound_1599 O=C(NC(=O)NCc1ccco1)CSc1nc2c(s1)ccc(c2)Cl 0.399 0.42 0.963 0.471 0.677 0.698 0.09 0.803 0.4 0.181 0.586 Compound_1600 CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)C=Nn1cnnc1 0.302 0.628 0.994 0.747 0.304 0.632 0.654 0.97 0.467 0.043 0.739 Compound_1601 CSCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccco1 0.593 0.65 0.109 0.444 0.475 0.636 0.976 0.384 0.403 0.041 0.914 Compound_1602 O=C1CC(=Nc2c(N1)cccc2)C=Cc1ccco1 0.409 0.559 0.97 0.584 0.379 0.626 0.251 0.96 0.526 0.128 0.594 Compound_1603 O=C(Nc1ccc(c(c1)c1nc2c(o1)cccn2)Cl)COc1ccccc1 0.46 0.683 0.979 0.709 0.674 0.654 0.993 0.92 0.566 0.123 0.636 Compound_1604 COC(=O)c1cc(NC2c3ccccc3C(=O)N2c2ccc(cn2)Cl)cc(c1)C(=O)OC 0.565 0.631 0.902 0.403 0.434 0.761 0.989 0.427 0.466 0.086 0.302 Compound_1605 O=C(c1ccccc1)Cn1c(=O)n(Cc2ccco2)c(=O)c2c1sc1c2CCCCC1 0.642 0.524 0.925 0.519 0.434 0.659 0.253 0.683 0.385 0.887 0.289 Compound_1606 N#Cc1c(SCc2nc(N)nc(n2)N2CCOCC2)nc(cc1C(F)(F)F)c1ccccc1 0.625 0.495 0.118 0.502 0.78 0.649 0.965 0.471 0.477 0.137 0.78 Compound_1607 NC(=O)COc1ccc(cc1)C1N(CC2CCCO2)C(=O)c2c1c(=O)c1c(o2)cccc1 0.726 0.657 0.457 0.395 0.108 0.637 0.457 0.368 0.304 0.222 0.288 Compound_1608 CSc1nc(NCc2ccco2)c2c(n1)cccc2 0.311 0.546 0.926 0.468 0.336 0.659 0.023 0.536 0.342 0.196 0.475 Compound_1609 COC(=O)c1cc(NC(=O)Cn2c(=O)cnc3c2cccc3)cc(c1)C(=O)OC 0.459 0.609 0.693 0.605 0.322 0.461 0.449 0.014 0.531 0.017 0.175 Compound_1610 OCCNC(=O)c1ccc2c(c1)nc(c(n2)c1ccco1)c1ccco1 0.299 0.541 0.586 0.414 0.531 0.607 0.954 0.01 0.258 0.397 0.727 Compound_1611 Brc1ccc(o1)C(=O)Nc1ccc2c(c1)nn(n2)c1ccccc1 0.481 0.678 0.903 0.726 0.616 0.647 0.23 0.973 0.617 0.789 0.421 Compound_1612 O=C(NC(=O)NCc1ccco1)CSc1cccc(c1)C(F)(F)F 0.128 0.354 0.702 0.421 0.366 0.674 0.391 0.685 0.374 0.016 0.591 Compound_1613 Brc1ccccc1c1nnc(o1)CSc1nnnn1c1ccccc1 0.479 0.466 0.596 0.618 0.633 0.66 0.628 0.683 0.534 0.157 0.524 Compound_1614 COc1ccc(cc1)N1CCN(CC1)C(=O)CCCn1c(=S)[nH]c2c(c1=O)cccc2 0.397 0.519 0.919 0.518 0.224 0.723 0.038 0.325 0.473 0.159 0.102 Compound_1615 Clc1ccc(c(c1)S(=O)(=O)Nc1nccs1)Cl 0.093 0.328 0.15 0.327 0.656 0.67 0.035 0.261 0.37 0.574 0.208 Compound_1616 COC(=O)COc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)OCO2 0.269 0.626 0.782 0.507 0.294 0.636 0.631 0.844 0.364 0.626 0.404 Compound_1617 CSc1ccc(cc1)C1C(=C(N)Oc2c1ccc(=O)c1c2c(C)oc1C)C#N 0.575 0.814 0.615 0.548 0.647 0.635 0.918 0.548 0.378 0.286 0.799 Compound_1618 N#Cc1cc2CN(C)CCc2nc1SCC(=O)Nc1ccc(cc1)F 0.549 0.541 0.927 0.425 0.667 0.646 0.012 0.558 0.46 0.135 0.653 Compound_1619 O=c1[nH]c(=O)n(c2c1n1CCCN(c1n2)CCc1ccccc1)C 0.318 0.488 0.003 0.262 0.21 0.482 0.003 0.019 0.553 0.057 0.118 Compound_1620 Oc1nc2cc3OCCOc3cc2cc1CN(Cc1nnnn1Cc1ccco1)Cc1cccs1 0.663 0.585 0.684 0.418 0.723 0.652 0.769 0.813 0.414 0.294 0.173 Compound_1621 O=C(Nc1ccncc1)OCCNC(=O)C 0.057 0.413 0.06 0.476 0.065 0.091 0.019 0.032 0.396 0.02 0.203 Compound_1622 Cn1c(SCC(=O)c2cccs2)nnc1Cc1ccccc1 0.584 0.638 0.223 0.488 0.201 0.815 0.946 0.09 0.457 0.006 0.363 Compound_1623 CCOC(=O)Cc1ccc(cc1)NS(=O)(=O)c1ccc(cc1)SC 0.094 0.453 0.491 0.51 0.432 0.559 0.707 0.043 0.168 0.245 0.238 Compound_1624 N#CC(=C(CSc1nnc(n1N)Cc1ccccc1F)O)C(=N)C 0.446 0.529 0.759 0.611 0.371 0.543 0.355 0.584 0.554 0.008 0.66 Compound_1625 O=C(Nc1nnc(s1)C1CC1)CCC(=O)c1cccs1 0.321 0.604 0.187 0.395 0.294 0.736 0.829 0.637 0.4 0.016 0.397 Compound_1626 O=C(Nc1ccc2c(c1)oc1c2cccc1)CSc1nnc(n1C)c1ccccc1 0.31 0.577 0.99 0.76 0.604 0.719 0.995 0.953 0.394 0.075 0.524 Compound_1627 N#Cc1c(N)oc(c1c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 0.4 0.73 0.988 0.779 0.803 0.664 0.937 0.9 0.764 0.925 0.897 Compound_1628 CCOc1cc(ccc1OCC)C=C1SC2N(C1=O)NC(N2)c1ccco1 0.515 0.593 0.077 0.475 0.418 0.646 0.072 0.673 0.396 0.697 0.636 Compound_1629 Fc1ccc(cc1)C1CC(=O)c2c(C1)nc(nc2)NCC1CCCO1 0.425 0.606 0.656 0.4 0.219 0.531 0.091 0.845 0.511 0.144 0.412 Compound_1630 Clc1cccc(c1)c1ccc(o1)C(=O)Nc1cc(ccc1C)c1sc2n(n1)c(nn2)C 0.487 0.675 0.669 0.681 0.584 0.658 0.99 0.534 0.421 0.693 0.255 Compound_1631 O=C1CC(C)(C)Cc2c1cnc(n2)NCC1CCCO1 0.268 0.61 0.353 0.329 0.043 0.348 0.002 0.667 0.249 0.009 0.121 Compound_1632 Clc1cc(CSc2ncccn2)c(c(c1)C(=O)c1cnc2c(c1)CN(C(=O)N2)C)O 0.555 0.398 0.443 0.486 0.472 0.663 0.52 0.625 0.419 0.242 0.621 Compound_1633 CCOc1ccc(cc1)N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccco1 0.608 0.625 0.07 0.436 0.729 0.662 0.951 0.951 0.367 0.168 0.597 Compound_1634 O=C(Cn1cc(c2c1cccc2)C(=O)c1ccco1)Nc1cccc(c1)C 0.51 0.535 0.988 0.596 0.104 0.454 0.995 0.643 0.564 0.12 0.773 Compound_1635 Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)CSc1ncc(cc1Cl)C(F)(F)F 0.238 0.589 0.331 0.702 0.484 0.595 0.603 0.968 0.409 0.604 0.317 Compound_1636 COc1ccc(cc1)N(C(=O)c1ccco1)CN1C(=O)C2C(C1=O)C1CC2C=C1 0.418 0.73 0.282 0.612 0.605 0.606 0.802 0.859 0.4 0.883 0.569 Compound_1637 O=C(CSc1cc(C)ccc1C)OCC(=O)c1ccco1 0.412 0.569 0.742 0.563 0.127 0.523 0.991 0.95 0.423 0.711 0.904 Compound_1638 OCCNC(=CC(=O)c1ccc(cc1)Cl)C(F)(F)F 0.104 0.313 0.332 0.588 0.517 0.555 0.368 0.061 0.27 0.036 0.51 Compound_1639 O=C(c1cccs1)Oc1cccc(c1)C=C1C(=O)NN(C1=O)c1ccc(c(c1)Cl)Cl 0.701 0.649 0.865 0.508 0.733 0.772 0.943 0.918 0.408 0.966 0.594 Compound_1640 Cc1cc(OCc2nc3c(n2)cc(c[nH]3)Br)cc(c1)C 0.382 0.685 0.853 0.518 0.537 0.659 0.008 0.038 0.615 0.194 0.709 Compound_1641 CCOc1cccc(c1)c1nnc2n1nc(s2)c1cc(OC)c(c(c1)OC)OC 0.447 0.65 0.849 0.75 0.489 0.732 0.373 0.941 0.444 0.645 0.868 Compound_1642 COc1ccc(cc1)Cc1nc2c([nH]1)ccc(c2)S(=O)(=O)N1CCOCC1 0.198 0.57 0.958 0.531 0.53 0.663 0.261 0.24 0.357 0.253 0.156 Compound_1643 O=C(C(N(C(=O)c1csnn1)Cc1cccs1)c1ccc(cc1)C)NC(C)(C)C 0.335 0.471 0.151 0.292 0.506 0.808 0.97 0.329 0.356 0.254 0.422 Compound_1644 O=C1CCC2=C1C(C1=C(O2)CCC1=O)c1cc2c(n1Cc1ccccc1)cccc2 0.692 0.751 0.986 0.547 0.723 0.559 0.9 0.947 0.332 0.079 0.44 Compound_1645 O=C1CCCC2=C1C(c1cc3c(n1Cc1ccccc1)cccc3)C1=C(O2)C(C)(C)CCC1=O 0.594 0.689 0.958 0.541 0.675 0.818 0.996 0.963 0.318 0.0 0.658 Compound_1646 CCCCOC(=O)c1cc(Cl)c(c(c1)Cl)O 0.783 0.212 0.92 0.692 0.936 0.715 0.968 0.406 0.755 0.725 0.508 Compound_1647 Oc1ccc(cc1)c1coc2c(c1=S)c(O)cc(c2)O 0.863 0.871 0.988 0.917 0.835 0.987 0.997 0.969 0.91 0.687 0.887 Compound_1648 CC(=CCc1c(ccc(c1O)O)C1CCc2c(O1)cc(cc2)O)C 0.407 0.688 0.609 0.66 0.966 0.256 0.198 0.974 0.451 0.507 0.536 Compound_1649 CCCCCCCCOC(=O)c1cc(N(=O)=O)c(c(c1)N(=O)=O)O 0.876 0.464 0.879 0.663 0.902 0.838 0.973 0.943 0.459 0.755 0.785 Compound_1650 O=C1CC(C)(C)CC2=C1C(C1=C(O2)CC(CC1=O)(C)C)c1cc2c(n1Cc1ccccc1)cccc2 0.599 0.699 0.979 0.52 0.756 0.855 0.994 0.955 0.438 0.436 0.824 Compound_1651 O=c1[nH]c(=O)c2c([nH]1)Oc1c(C2c2cc3c(n2Cc2ccccc2)cccc3)c(=O)[nH]c(=O)[nH]1 0.607 0.632 0.93 0.413 0.5 0.719 0.843 0.388 0.377 0.042 0.79 Compound_1652 CC=C1C(=O)CC2C1(C)CCC1C2CCC2=CC(=O)CCC12C 0.997 1.0 0.066 0.783 0.905 0.898 0.015 0.916 0.147 0.999 0.401 Compound_1653 COc1cc2CCC3C(c2cc1CCC(=O)c1ccc(c(c1)OC)O)CCC1(C3CCC1O)C 0.817 0.883 0.007 0.455 0.963 0.927 0.807 0.871 0.2 0.822 0.913 Compound_1654 COc1ccc2c(c1)CCC1C2CCC2(C1CCC2OC(=O)C)C 0.925 0.748 0.025 0.502 0.979 0.98 0.008 0.83 0.281 0.997 0.82 Compound_1655 COc1cc2CCC3C(c2cc1C=O)CCC1(C3CCC1OC(=O)C)C 0.934 0.752 0.009 0.442 0.827 0.98 0.163 0.732 0.595 0.825 0.962 Compound_1656 Oc1ccc(cn1)n1cnc2c(c1=O)c(O)cc(c2)O 0.689 0.646 0.785 0.509 0.686 0.604 0.214 0.65 0.474 0.182 0.569 Compound_1657 O=C(c1ccc(cc1)c1ccc2c(n1)Oc1c(C2C(C(=O)Nc2scnn2)(C)C)cccc1F)N1CCOCC1 0.686 0.688 0.605 0.647 0.428 0.775 1.0 0.786 0.405 0.269 0.34 Compound_1658 NC(=O)NC(=O)C(C1c2ccc(nc2Oc2c1cccc2F)c1ccc(cc1)C(=O)N1CCOCC1)(C)C 0.697 0.593 0.12 0.507 0.759 0.846 0.975 0.669 0.409 0.06 0.607 Compound_1659 NS(=O)(=O)Oc1ccc2c(c1)oc(n2)C=C1C2CC3CC1CC(C2)C3 0.348 0.625 0.992 0.445 0.766 0.648 0.92 0.237 0.318 0.076 0.579 Compound_1660 COc1ccc2c(c1)C(=O)c1c2n(c2ccc(cc2)OCCCN2CCOCC2)c(=O)c2c1ccc(c2)OC 0.759 0.684 0.133 0.514 0.705 0.565 0.569 0.807 0.343 0.193 0.309 Compound_1661 N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C 0.575 0.506 0.903 0.711 0.824 0.53 0.855 0.957 0.406 0.674 0.453 Compound_1662 COc1ccc2c(c1)c(=O)n(c1c2C(=O)c2c1ccc(c2)OC)c1ccc(cc1)OCCN1CCOCC1 0.7 0.684 0.237 0.666 0.703 0.572 0.548 0.654 0.31 0.193 0.309 Compound_1663 CCCCCCCCCCCCCCCCCCNCCOc1ccc(cc1)C(=C(c1ccccc1)CC)c1ccc(cc1)O 0.274 0.48 0.017 0.376 0.907 0.978 0.038 0.137 0.614 0.396 0.201 Compound_1664 CC(C(C(c1ccccc1)Oc1ccc2c(c1)cnn2c1ccc(=O)n(c1)C)NC(=O)C(F)(F)C)C 0.567 0.676 0.314 0.525 0.893 0.67 0.907 0.14 0.423 0.158 0.411 Compound_1665 CC(=CCc1c(cc(c(c1CC=C(C)C)O)O)C1CCc2c(O1)cc(cc2)O)C 0.483 0.68 0.667 0.644 0.957 0.389 0.192 0.978 0.579 0.692 0.821 Compound_1666 CCCCOC(=O)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 0.712 0.267 0.667 0.673 0.871 0.984 0.689 0.453 0.73 0.252 0.282 Compound_1667 CCCCOC(=O)c1cc(OC)c(c(c1)OC)O 0.67 0.284 0.902 0.676 0.827 0.083 0.531 0.342 0.669 0.294 0.533 Compound_1668 CCCCOC(=O)c1cc(N(=O)=O)c(c(c1)N(=O)=O)O 0.727 0.372 0.879 0.676 0.868 0.82 0.965 0.843 0.449 0.274 0.742 Compound_1669 CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3c(n2Cc2ccccc2)cccc3)C(=O)CCC1(C)C 0.594 0.694 0.955 0.483 0.688 0.831 0.995 0.946 0.378 0.029 0.671 Compound_1670 CC1CC(=O)C2=C(C1)OC1=C(C2c2cc3c(n2Cc2ccccc2)cccc3)C(=O)CC(C1)C 0.589 0.649 0.955 0.534 0.688 0.822 0.994 0.946 0.438 0.016 0.808 Compound_1671 O=C1CC(C)(C)CC2=C1C(c1cc3c(n1Cc1ccccc1)cccc3)C1=C(O2)C(C)(C)CCC1=O 0.603 0.694 0.979 0.486 0.734 0.857 0.995 0.949 0.36 0.029 0.671 Compound_1672 COc1cc(ccc1O)c1cc(=O)c2c(o1)ccc(c2)O 0.899 0.859 0.951 0.815 0.861 0.574 0.923 0.987 0.565 0.01 0.942 Compound_1673 O=c1nc2c3ccccc3Cn2c2c1cc1ccccc1c2 0.505 0.787 0.946 0.763 0.698 0.69 0.982 0.984 0.785 0.533 0.233 Compound_1674 COc1ccccc1Oc1coc2c(c1=O)ccc(c2)O 0.691 0.772 0.931 0.697 0.689 0.582 0.947 0.239 0.622 0.016 0.919 Compound_1675 Oc1ccc(cc1)CCC(=O)c1ccc(cc1O)O 0.928 0.648 0.445 0.646 0.92 0.982 0.99 0.712 0.406 0.765 0.301 Compound_1676 Oc1ccc2c(c1)oc(c(c2=O)c1cc2c(o1)cccc2)C(F)(F)F 0.533 0.66 0.933 0.712 0.888 0.947 0.981 0.983 0.228 0.158 0.989 Compound_1677 Oc1ccc(cc1)C1=COc2c(C1)ccc(c2)O 0.623 0.902 0.88 0.663 0.96 0.886 0.972 0.568 0.703 0.705 0.974 Compound_1678 COc1cccc(c1)COc1ccc2c(c1)oc(=O)c1c2CCC1 0.738 0.717 0.861 0.7 0.828 0.656 0.991 0.535 0.379 0.431 0.819 Compound_1679 c1ccc(cc1)CCc1cc(NCc2ccccc2)nc(n1)NCc1ccccc1 0.362 0.534 0.347 0.478 0.882 0.955 0.561 0.253 0.227 0.065 0.5 Compound_1680 O=C(Nc1ccc(c(c1)Cl)C)CSc1nnc(n1C)Cn1c(=O)sc2c1cccc2 0.577 0.569 0.978 0.705 0.545 0.84 0.969 0.367 0.553 0.236 0.359 Compound_1681 O=c1oc2ccccc2cc1C(=O)N(Cc1cccs1)Cc1ccco1 0.361 0.591 0.937 0.537 0.307 0.793 0.584 0.775 0.385 0.95 0.49 Compound_1682 COc1ccc(c(c1)C(=O)CSc1nnc(o1)c1ccc(c(c1)OC)OC)OC 0.439 0.568 0.937 0.79 0.628 0.662 0.929 0.902 0.408 0.39 0.842 Compound_1683 O=C(C(c1ccccc1)O)OCC(=O)c1ccc2c(c1)OCCO2 0.178 0.477 0.261 0.41 0.7 0.354 0.345 0.061 0.334 0.802 0.942 Compound_1684 CCOC(=O)N1C(OCC)C=Cc2c1cccc2 0.669 0.58 0.93 0.785 0.299 0.768 0.065 0.824 0.438 0.49 0.385 Compound_1685 CCOC(=O)c1sc(nc1C)NC(=O)c1ccc2c(c1)scn2 0.635 0.634 1.001 0.64 0.435 0.814 0.69 0.923 0.603 0.046 0.641 Compound_1686 COc1ccc(cc1)c1c(C#N)c(C)nc2c1C(=O)c1c2cccc1 0.66 0.797 0.972 0.839 0.668 0.641 0.941 0.952 0.689 0.118 0.976 Compound_1687 CCOC(=O)Cn1c(nc2c1cccc2)c1nonc1NC(=O)c1ccccc1F 0.534 0.664 0.99 0.691 0.739 0.642 0.99 0.873 0.359 0.951 0.558 Compound_1688 CCOC(=O)c1c(NC(=O)CSc2nnc(o2)c2ccccc2)sc(c1C)C(=O)C 0.556 0.652 0.973 0.612 0.448 0.641 0.99 0.893 0.416 0.492 0.699 Compound_1689 O=C(c1cccnc1)Nc1ccc(cc1)c1noc(n1)c1cccs1 0.368 0.635 0.94 0.691 0.635 0.692 0.94 0.81 0.261 0.04 0.12 Compound_1690 O=C(Cc1ccc(cc1)Cl)Nc1ccc2c(c1)nc(o2)c1ccncc1 0.192 0.567 1.0 0.766 0.691 0.621 0.993 0.761 0.532 0.264 0.59 Compound_1691 Cc1ccc(cc1)S(=O)(=O)c1nc(sc1NCC1CCCO1)S(=O)(=O)C 0.447 0.549 0.128 0.403 0.532 0.601 0.071 0.312 0.369 0.118 0.197 Compound_1692 OC(=O)c1cccc(c1)n1c(C)ccc1C 0.405 0.474 0.029 0.349 0.449 0.597 0.757 0.465 0.624 0.006 0.366 Compound_1693 O=C(C(C)(C)C)Oc1ccc2c(c1)OC(C(=C2C)c1ccc(cc1)OC(=O)C(C)(C)C)c1ccc(cc1)OCCN1CCCCC1 0.545 0.838 0.066 0.451 0.928 0.57 0.305 0.778 0.307 0.961 0.549 Compound_1694 Oc1ccc2c(c1)OC(C(=C2C)c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCCC1 0.518 0.731 0.188 0.58 0.93 0.714 0.056 0.589 0.292 0.742 0.442 Compound_1695 FCCCN1CC(C1)Nc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.535 0.485 0.831 0.225 0.957 0.785 0.063 0.814 0.298 0.885 0.619 Compound_1696 FCCCNCCOc1ccc(c(c1C)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.481 0.649 0.873 0.344 0.908 0.671 0.952 0.151 0.424 0.093 0.601 Compound_1697 FCC1CN(C1)CCOc1ccc(c(c1)F)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.492 0.453 0.373 0.567 0.964 0.666 0.9 0.796 0.212 0.809 0.438 Compound_1698 FCC1CCN(C1)C(COc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1)C 0.422 0.639 0.633 0.422 0.962 0.934 0.062 0.877 0.175 0.835 0.6 Compound_1699 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccc(cc1)C#N 0.551 0.497 0.143 0.535 0.971 0.579 0.477 0.838 0.374 0.853 0.72 Compound_1700 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.495 0.453 0.447 0.556 0.964 0.666 0.9 0.736 0.311 0.809 0.438 Compound_1701 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.565 0.581 0.363 0.198 0.936 0.667 0.934 0.297 0.33 0.14 0.482 Compound_1702 FCCCNCCOc1ncc(c(c1C)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.582 0.664 0.477 0.305 0.683 0.671 0.956 0.193 0.323 0.096 0.362 Compound_1703 FCC1CN(C1)CCOc1ccc(cn1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.599 0.557 0.459 0.456 0.744 0.595 0.104 0.579 0.045 0.846 0.465 Compound_1704 FCCCN1CC(C1)Nc1ccc(nc1F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.57 0.647 0.965 0.187 0.829 0.672 0.982 0.732 0.525 0.017 0.342 Compound_1705 FCCCN1CC(C1)Nc1ccc(cc1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.465 0.647 0.888 0.22 0.821 0.649 0.963 0.676 0.565 0.01 0.395 Compound_1706 FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.49 0.647 0.677 0.217 0.822 0.65 0.963 0.823 0.511 0.017 0.342 Compound_1707 FCCCNCCOc1ncc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.607 0.655 0.608 0.31 0.682 0.661 0.932 0.238 0.359 0.259 0.316 Compound_1708 FCCCNCCOc1ncc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.661 0.653 0.121 0.261 0.635 0.623 0.924 0.319 0.39 0.052 0.492 Compound_1709 FCCCN1CC(C1)Oc1ccc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.602 0.586 0.832 0.289 0.847 0.657 0.955 0.734 0.565 0.09 0.442 Compound_1710 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.517 0.586 0.991 0.293 0.827 0.653 0.976 0.675 0.617 0.803 0.56 Compound_1711 CCC(C(c1ccc(cc1)O)C#N)c1ccc(cc1)O 0.627 0.782 0.138 0.577 0.965 0.854 0.961 0.784 0.362 0.239 0.919 Compound_1712 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.505 0.556 0.959 0.294 0.85 0.648 0.974 0.569 0.551 0.129 0.56 Compound_1713 FCCCNCCOc1ccc(c(c1C)C1N(CCC#N)C(C)Cc2c1[nH]c1c2cccc1)F 0.487 0.599 0.652 0.342 0.849 0.688 0.946 0.51 0.442 0.138 0.753 Compound_1714 FCCCNCCOc1ncc(c(c1Cl)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.611 0.635 0.23 0.28 0.693 0.655 0.963 0.182 0.385 0.585 0.453 Compound_1715 FCCCNCCOc1ncc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.592 0.655 0.23 0.28 0.682 0.661 0.932 0.182 0.338 0.259 0.316 Compound_1716 FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.5 0.637 0.768 0.217 0.822 0.65 0.963 0.859 0.545 0.021 0.274 Compound_1717 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2c(F)ccc1)F 0.518 0.63 0.738 0.299 0.927 0.661 0.932 0.109 0.413 0.253 0.511 Compound_1718 FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.521 0.627 0.892 0.225 0.804 0.648 0.869 0.643 0.451 0.01 0.397 Compound_1719 FCCCN1CC(C1)Nc1ccc(cc1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.475 0.647 0.927 0.22 0.775 0.646 0.963 0.762 0.641 0.016 0.333 Compound_1720 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.505 0.63 0.801 0.309 0.927 0.661 0.932 0.158 0.422 0.253 0.511 Compound_1721 FCCCNCCOc1ncc(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.68 0.685 0.247 0.248 0.611 0.687 0.964 0.481 0.269 0.576 0.56 Compound_1722 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.46 0.681 0.095 0.328 0.915 0.713 0.95 0.408 0.391 0.636 0.531 Compound_1723 FCCCNCCOc1ccc(c(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.47 0.628 0.744 0.336 0.902 0.67 0.908 0.415 0.438 0.088 0.616 Compound_1724 FCCCNCCOc1nccc(c1C)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.59 0.67 0.203 0.3 0.511 0.684 0.956 0.165 0.323 0.076 0.5 Compound_1725 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(CO)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.477 0.696 0.067 0.279 0.918 0.7 0.927 0.173 0.341 0.148 0.575 Compound_1726 FCCCNCCOc1ccc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.597 0.69 0.521 0.244 0.913 0.697 0.8 0.256 0.297 0.024 0.729 Compound_1727 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(COC)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.494 0.747 0.123 0.312 0.927 0.71 0.941 0.374 0.386 0.529 0.777 Compound_1728 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.467 0.562 0.476 0.313 0.923 0.674 0.915 0.325 0.426 0.255 0.548 Compound_1729 FCCCNCCOc1ccc(c(c1Cl)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.533 0.63 0.68 0.289 0.879 0.66 0.937 0.108 0.424 0.577 0.667 Compound_1730 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.485 0.63 0.68 0.289 0.927 0.661 0.932 0.108 0.417 0.253 0.511 Compound_1731 FCCCNCCNc1cc(F)c(c(c1)F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.477 0.642 0.625 0.243 0.918 0.719 0.835 0.44 0.246 0.027 0.472 Compound_1732 FCCCNCCOc1ccc(c(c1)OC)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.568 0.613 0.197 0.261 0.946 0.683 0.836 0.272 0.34 0.061 0.69 Compound_1733 FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.523 0.697 0.63 0.215 0.818 0.651 0.963 0.828 0.554 0.01 0.351 Compound_1734 FCCCNCCOc1cccc(c1C(F)F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.5 0.626 0.247 0.223 0.908 0.671 0.952 0.086 0.211 0.209 0.643 Compound_1735 FCCCNCCOc1nccc(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.572 0.703 0.075 0.299 0.655 0.671 0.892 0.396 0.342 0.061 0.507 Compound_1736 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.551 0.647 0.96 0.179 0.755 0.66 0.982 0.708 0.341 0.017 0.342 Compound_1737 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.517 0.566 0.975 0.273 0.827 0.653 0.976 0.657 0.626 0.217 0.508 Compound_1738 FCCCN(CCOc1ncc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)F)C 0.604 0.657 0.751 0.296 0.688 0.661 0.948 0.369 0.365 0.043 0.477 Compound_1739 FCC1CCN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.449 0.539 0.596 0.53 0.972 0.944 0.143 0.78 0.208 0.92 0.508 Compound_1740 FCCCN1CC(C1)Nc1ccc(c(n1)F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.492 0.649 0.912 0.209 0.793 0.679 0.986 0.649 0.478 0.035 0.31 Compound_1741 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.55 0.647 0.958 0.16 0.755 0.66 0.982 0.843 0.548 0.017 0.342 Compound_1742 COCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)NC1CN(C1)CCCF)ccc1c2cn[nH]1)(F)F 0.536 0.611 0.984 0.284 0.837 0.654 0.987 0.585 0.536 0.732 0.627 Compound_1743 FCCCN1CC(C1)Oc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.462 0.486 0.366 0.388 0.952 0.651 0.196 0.775 0.165 0.689 0.457 Compound_1744 COCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)OC1CN(C1)CCCF)ccc1c2cn[nH]1)(F)C 0.613 0.721 0.801 0.334 0.836 0.662 0.955 0.604 0.511 0.424 0.621 Compound_1745 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)Cl 0.505 0.552 0.794 0.332 0.895 0.68 0.921 0.422 0.307 0.705 0.695 Compound_1746 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.534 0.647 0.924 0.216 0.759 0.658 0.982 0.708 0.341 0.01 0.395 Compound_1747 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)Cl 0.516 0.552 0.476 0.313 0.895 0.679 0.921 0.325 0.308 0.705 0.695 Compound_1748 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.477 0.63 0.342 0.289 0.935 0.682 0.888 0.155 0.339 0.253 0.511 Compound_1749 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.474 0.57 0.5 0.282 0.923 0.674 0.915 0.359 0.437 0.37 0.421 Compound_1750 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.564 0.603 0.166 0.256 0.937 0.667 0.934 0.353 0.26 0.074 0.708 Compound_1751 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1F)F 0.498 0.63 0.324 0.289 0.915 0.656 0.932 0.107 0.413 0.253 0.511 Compound_1752 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.582 0.627 0.991 0.197 0.729 0.657 0.946 0.366 0.262 0.01 0.397 Compound_1753 FCCCNCCNc1cc(F)c(c(c1)F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.448 0.59 0.35 0.26 0.929 0.733 0.948 0.702 0.334 0.015 0.176 Compound_1754 FCCCN1CC(C1)Nc1ccc(nc1F)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.601 0.627 0.992 0.206 0.811 0.668 0.946 0.395 0.411 0.01 0.397 Compound_1755 FCCCNCCOc1ccc(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.58 0.67 0.323 0.258 0.921 0.704 0.892 0.264 0.389 0.553 0.761 Compound_1756 FCCCNC(COc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1)CO 0.458 0.682 0.219 0.269 0.908 0.701 0.902 0.159 0.42 0.62 0.615 Compound_1757 FCCCNCCOc1ccc(c(c1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)Cl 0.526 0.63 0.901 0.299 0.862 0.676 0.937 0.132 0.273 0.577 0.667 Compound_1758 FC(CCNCCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.46 0.681 0.095 0.317 0.932 0.708 0.95 0.408 0.357 0.636 0.531 Compound_1759 FCCCNCCNc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.511 0.642 0.821 0.263 0.886 0.693 0.9 0.205 0.273 0.027 0.472 Compound_1760 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.56 0.603 0.265 0.229 0.936 0.667 0.934 0.255 0.293 0.093 0.593 Compound_1761 FCCCNCCOc1ncc(c(c1)OC)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.679 0.633 0.136 0.251 0.736 0.666 0.943 0.344 0.231 0.067 0.5 Compound_1762 FCCCNCCOc1ncc(c(c1)OC)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.68 0.748 0.136 0.221 0.549 0.691 0.964 0.336 0.297 0.633 0.487 Compound_1763 FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)C1N(CC(CO)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.514 0.647 0.392 0.244 0.791 0.654 0.869 0.636 0.451 0.012 0.411 Compound_1764 O=NCc1ccc(c(c1)c1ccccc1)c1ccccc1 0.859 0.602 0.717 0.671 0.408 0.973 0.956 0.841 0.724 0.796 0.819 Compound_1765 FCCCNC(COc1ccc(c(c1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC)C 0.577 0.659 0.715 0.212 0.897 0.676 0.952 0.239 0.176 0.303 0.866 Compound_1766 FCCCNCCOc1ccc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.574 0.6 0.279 0.22 0.921 0.704 0.892 0.299 0.398 0.118 0.6 Compound_1767 FCCCNCCOc1ccc(c(c1F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1)OC 0.585 0.643 0.212 0.268 0.874 0.668 0.962 0.319 0.331 0.04 0.568 Compound_1768 FCCCNCCOc1ccc(c(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.477 0.648 0.123 0.283 0.907 0.702 0.919 0.396 0.275 0.385 0.767 Compound_1769 FCCCNCCOc1ccc(c(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.556 0.648 0.157 0.26 0.931 0.673 0.962 0.319 0.253 0.498 0.831 Compound_1770 FCCCNCCOc1ccc(c(c1)OC)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.61 0.653 0.155 0.299 0.89 0.679 0.892 0.284 0.387 0.033 0.562 Compound_1771 CC(Cc1cccc(c1C)N)NC(=O)C(F)(F)F 0.147 0.636 0.312 0.365 0.069 0.033 0.075 0.516 0.408 0.003 0.173 Compound_1772 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)C1CCOCC1 0.719 0.531 0.287 0.549 0.864 0.665 0.262 0.823 0.28 0.464 0.509 Compound_1773 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.572 0.661 0.584 0.222 0.93 0.667 0.952 0.231 0.271 0.037 0.631 Compound_1774 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)OC 0.586 0.661 0.931 0.283 0.93 0.667 0.952 0.241 0.28 0.037 0.631 Compound_1775 FCCCN1CC(C1)Nc1ccc(cc1F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.495 0.647 0.923 0.217 0.822 0.65 0.963 0.658 0.557 0.017 0.342 Compound_1776 FCCCNCCOc1ncc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.683 0.645 0.2 0.221 0.609 0.677 0.943 0.363 0.276 0.135 0.402 Compound_1777 FCCCNCCOc1nccc(c1Cl)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.592 0.635 0.28 0.28 0.585 0.658 0.963 0.167 0.385 0.585 0.453 Compound_1778 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC(CF)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.565 0.677 0.993 0.186 0.762 0.659 0.982 0.868 0.595 0.01 0.318 Compound_1779 FCCCNCCNc1cc(F)c(c(c1)F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.496 0.652 0.196 0.305 0.893 0.705 0.971 0.701 0.3 0.016 0.507 Compound_1780 ClCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.479 0.508 0.305 0.518 0.979 0.739 0.092 0.795 0.269 0.832 0.699 Compound_1781 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)C1CCC(CC1)(F)F 0.678 0.488 0.439 0.544 0.956 0.696 0.977 0.714 0.313 0.708 0.52 Compound_1782 FCCCN(CCOc1ncc(c(c1C)C1N(C(CC(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.576 0.734 0.125 0.317 0.526 0.67 0.988 0.525 0.224 0.549 0.425 Compound_1783 FC(C1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1)F 0.467 0.467 0.305 0.524 0.976 0.662 0.939 0.843 0.185 0.811 0.5 Compound_1784 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.531 0.582 0.991 0.312 0.827 0.651 0.972 0.477 0.482 0.033 0.545 Compound_1785 FCCCNCCOc1cncc(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.563 0.648 0.129 0.325 0.624 0.622 0.912 0.472 0.354 0.064 0.748 Compound_1786 FCCCN1CC(C1)Nc1cnc(cn1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.512 0.649 0.913 0.183 0.762 0.674 0.986 0.667 0.499 0.035 0.31 Compound_1787 FCCCNCCOc1ccc(c(c1)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.57 0.587 0.239 0.215 0.907 0.688 0.962 0.386 0.297 0.142 0.622 Compound_1788 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.46 0.629 0.17 0.322 0.932 0.694 0.915 0.379 0.378 0.134 0.514 Compound_1789 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2ccc(c1)F)F 0.5 0.63 0.297 0.309 0.927 0.661 0.932 0.15 0.422 0.253 0.511 Compound_1790 FCCCNCCOc1ccc(c(c1)F)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.497 0.629 0.405 0.332 0.932 0.694 0.915 0.353 0.351 0.134 0.514 Compound_1791 Oc1ccc2c(c1)ccc(c2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.273 0.527 0.632 0.697 0.944 0.924 0.234 0.935 0.437 0.466 0.469 Compound_1792 FCCCNCCOc1ccnc(c1C)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.526 0.645 0.651 0.246 0.624 0.682 0.967 0.226 0.2 0.064 0.742 Compound_1793 FCCCN1CC(C1)Nc1ccc(nc1F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.568 0.647 0.964 0.226 0.791 0.661 0.982 0.708 0.525 0.017 0.342 Compound_1794 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1CC(F)(F)F)F 0.835 0.628 0.939 0.571 0.941 0.72 0.958 0.913 0.652 0.965 0.718 Compound_1795 FCCCNCCOc1ncnc(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.603 0.698 0.386 0.27 0.731 0.686 0.903 0.484 0.315 0.109 0.384 Compound_1796 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1CC(F)(F)F 0.848 0.638 0.745 0.637 0.944 0.738 0.958 0.912 0.677 0.968 0.793 Compound_1797 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2F)O)c1ccccc1C(C)C 0.836 0.656 0.764 0.627 0.947 0.746 0.997 0.902 0.606 0.948 0.641 Compound_1798 FCCCNCCOc1ccc(c(c1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.585 0.668 0.496 0.24 0.897 0.676 0.952 0.251 0.237 0.029 0.746 Compound_1799 CCC(c1ccccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.793 0.793 0.179 0.654 0.928 0.743 0.992 0.901 0.641 0.939 0.513 Compound_1800 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1cc(F)ccc1CC(F)(F)F 0.849 0.628 0.941 0.619 0.941 0.72 0.958 0.911 0.76 0.965 0.718 Compound_1801 FCC1CN(C1)CCNc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.525 0.456 0.721 0.312 0.959 0.78 0.037 0.457 0.279 0.197 0.588 Compound_1802 FCC1CN(C1)CCOc1ccc(cc1)C1c2ccc(cc2CCC21CCCC2)O 0.6 0.554 0.197 0.557 0.925 0.849 0.202 0.796 0.285 0.617 0.596 Compound_1803 FCCCNCCOc1ncc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.702 0.673 0.497 0.268 0.592 0.68 0.947 0.311 0.204 0.026 0.55 Compound_1804 FCCCN(CCOc1ncc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)F)C 0.588 0.762 0.599 0.323 0.54 0.674 0.988 0.61 0.262 0.549 0.458 Compound_1805 FCCCNCCNc1ccc(c(n1)OC)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.604 0.65 0.589 0.301 0.69 0.733 0.942 0.835 0.169 0.74 0.534 Compound_1806 FCCCN1CC(C1)N(c1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1)C 0.523 0.646 0.829 0.302 0.83 0.654 0.946 0.576 0.631 0.799 0.5 Compound_1807 FCCCNCCOc1ccc(c(c1F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1)F 0.498 0.657 0.426 0.313 0.911 0.669 0.915 0.327 0.44 0.18 0.628 Compound_1808 FCCCNCCOc1ncc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.572 0.628 0.057 0.269 0.667 0.67 0.892 0.404 0.357 0.22 0.349 Compound_1809 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.512 0.668 0.959 0.3 0.817 0.655 0.976 0.514 0.64 0.824 0.543 Compound_1810 FCCCNCCOc1ccc(c(c1F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1)F 0.505 0.653 0.436 0.345 0.902 0.658 0.939 0.399 0.44 0.271 0.507 Compound_1811 FCCCN1CC(C1)N(c1ccc(nc1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1)C 0.517 0.677 0.768 0.243 0.765 0.657 0.984 0.883 0.315 0.008 0.354 Compound_1812 FCCCNCCOc1ccc(c(c1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)F)OC 0.601 0.661 0.935 0.304 0.93 0.667 0.952 0.346 0.257 0.037 0.631 Compound_1813 CCC(=C(c1ccc(cc1)O)CCCCCCN(CCCSCCCC(C(F)(F)F)(F)F)C)c1ccc(cc1)O 0.612 0.539 0.158 0.489 0.955 0.927 0.671 0.733 0.266 0.233 0.862 Compound_1814 FCCCNCCNc1cc(F)c(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.478 0.702 0.217 0.24 0.922 0.731 0.97 0.659 0.347 0.006 0.331 Compound_1815 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccc(cc1)S(=O)(=O)C 0.44 0.549 0.154 0.486 0.854 0.63 0.036 0.804 0.377 0.557 0.448 Compound_1816 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.48 0.562 0.794 0.332 0.923 0.674 0.915 0.422 0.463 0.255 0.548 Compound_1817 FCCCNCCNc1ccc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.56 0.51 0.583 0.249 0.933 0.7 0.971 0.41 0.193 0.13 0.754 Compound_1818 FCCCNCCNc1ccc(c(c1)OC)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.595 0.618 0.376 0.282 0.918 0.682 0.984 0.225 0.185 0.066 0.636 Compound_1819 FCCCNCCNc1ccc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.581 0.58 0.834 0.253 0.937 0.691 0.973 0.313 0.112 0.053 0.838 Compound_1820 FCCCNCCN(c1cc(F)c(c(c1)F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.421 0.589 0.292 0.241 0.929 0.733 0.948 0.469 0.488 0.019 0.14 Compound_1821 FCCCNCCOc1cccc(c1Cl)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.517 0.552 0.234 0.264 0.877 0.667 0.921 0.31 0.296 0.705 0.695 Compound_1822 FCCCN1CC(C1)N(c1ccc(nc1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1)C 0.525 0.697 0.84 0.202 0.71 0.658 0.984 0.925 0.365 0.013 0.288 Compound_1823 CCCCc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.897 0.534 0.176 0.803 0.846 0.771 0.947 0.809 0.511 0.159 0.645 Compound_1824 FCCCNCCOc1ccc(c(c1)F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.485 0.57 0.357 0.302 0.932 0.694 0.915 0.406 0.358 0.37 0.421 Compound_1825 FCCCN1CC(C1)Nc1cc(OC)c(cc1F)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.577 0.656 0.967 0.282 0.823 0.655 0.976 0.522 0.609 0.121 0.538 Compound_1826 FCCCNCCOc1ncc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.595 0.628 0.14 0.275 0.686 0.671 0.892 0.4 0.357 0.22 0.349 Compound_1827 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.481 0.657 0.079 0.322 0.921 0.686 0.915 0.408 0.391 0.18 0.628 Compound_1828 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC2(CF)COC2)C(C)Cc2c1ccc1c2cn[nH]1 0.505 0.677 0.956 0.314 0.778 0.657 0.987 0.589 0.586 0.091 0.623 Compound_1829 FCCCNCCOc1ccc(cc1)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.46 0.635 0.169 0.278 0.892 0.724 0.95 0.252 0.31 0.113 0.649 Compound_1830 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.521 0.566 0.969 0.273 0.817 0.655 0.976 0.635 0.626 0.724 0.521 Compound_1831 FCCCNCCOc1ccc(c(c1F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1)OC 0.58 0.716 0.227 0.229 0.899 0.678 0.962 0.242 0.342 0.084 0.641 Compound_1832 FCCCN1CC(C1)Nc1cnc(cn1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.492 0.659 0.845 0.22 0.756 0.674 0.986 0.656 0.499 0.021 0.364 Compound_1833 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.547 0.647 0.921 0.197 0.762 0.659 0.982 0.843 0.548 0.017 0.342 Compound_1834 FCCCNCCNc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.448 0.622 0.404 0.281 0.897 0.703 0.977 0.44 0.307 0.009 0.287 Compound_1835 Oc1ccc2c(c1)CN(c1c2ccc2c1ccc(c2)O)c1ccc(cc1)OCCN1CCCCC1 0.409 0.542 0.778 0.603 0.973 0.914 0.304 0.974 0.479 0.61 0.832 Compound_1836 FCCCNCCOc1ccc(c(c1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1)OC 0.599 0.643 0.129 0.305 0.873 0.668 0.962 0.362 0.299 0.04 0.568 Compound_1837 FCCCNCCOc1cnc(c(c1)OC)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.638 0.738 0.297 0.211 0.473 0.634 0.964 0.487 0.442 0.574 0.695 Compound_1838 FCCCNCCOc1cccc(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.476 0.628 0.198 0.29 0.902 0.67 0.908 0.391 0.24 0.074 0.728 Compound_1839 FCCCNCCOc1ncc(c(c1F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1)F 0.606 0.703 0.047 0.257 0.664 0.666 0.892 0.395 0.393 0.153 0.419 Compound_1840 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1(C)N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.529 0.701 0.954 0.297 0.812 0.655 0.976 0.696 0.635 0.752 0.625 Compound_1841 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(c(c1)F)O 0.953 0.409 0.156 0.78 0.841 0.732 0.948 0.84 0.487 0.968 0.892 Compound_1842 O=NCc1c(O)ccc(c1c1ccc(cc1)O)c1ccc(cc1)O 0.624 0.623 0.855 0.764 0.886 0.992 0.74 0.981 0.835 0.166 0.593 Compound_1843 FCCCNCCNc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.566 0.497 0.426 0.248 0.922 0.716 0.955 0.332 0.18 0.069 0.726 Compound_1844 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.545 0.722 0.924 0.224 0.687 0.664 0.983 0.673 0.413 0.239 0.361 Compound_1845 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(ccc2c2c1c1ccc(cc1nc2)O)C(F)(F)F 0.436 0.563 0.87 0.606 0.973 0.624 0.913 0.964 0.328 0.371 0.691 Compound_1846 FCCCNCCOc1ncnc(c1C)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.614 0.645 0.74 0.298 0.617 0.695 0.968 0.233 0.299 0.11 0.379 Compound_1847 FCCCNCCN(c1cc(F)c(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1)C 0.457 0.699 0.175 0.251 0.922 0.731 0.97 0.416 0.499 0.007 0.262 Compound_1848 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.549 0.667 0.979 0.215 0.7 0.659 0.982 0.872 0.386 0.006 0.351 Compound_1849 FCCCNCCNc1ccc(c(n1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.607 0.62 0.46 0.253 0.69 0.733 0.942 0.786 0.173 0.266 0.392 Compound_1850 FCCCNCCOc1cc(F)c(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.494 0.562 0.515 0.304 0.923 0.674 0.915 0.833 0.452 0.255 0.548 Compound_1851 FCCCNCCOc1ccc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)C)F 0.494 0.629 0.819 0.343 0.932 0.687 0.969 0.157 0.422 0.148 0.491 Compound_1852 FCCCNCCNc1ncc(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.581 0.575 0.586 0.247 0.557 0.714 0.948 0.585 0.129 0.775 0.768 Compound_1853 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.542 0.647 0.951 0.216 0.7 0.659 0.982 0.79 0.392 0.016 0.333 Compound_1854 COCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)NC1CN(C1)CCCF)ccc1c2cn[nH]1)(F)C 0.531 0.681 0.956 0.322 0.827 0.656 0.987 0.513 0.533 0.776 0.648 Compound_1855 FCCCNCCOc1ncc(c(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cc(cc1)C)F 0.6 0.654 0.307 0.325 0.705 0.664 0.952 0.454 0.345 0.152 0.274 Compound_1856 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(Cl)cccc2c2c1c1ccc(cc1nc2)O 0.505 0.61 0.755 0.572 0.903 0.662 0.634 0.934 0.424 0.75 0.693 Compound_1857 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.505 0.669 0.664 0.319 0.865 0.674 0.986 0.362 0.37 0.31 0.478 Compound_1858 FCCCNCCOc1ccc(c(c1)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1)OC 0.593 0.716 0.14 0.256 0.899 0.678 0.962 0.338 0.312 0.084 0.641 Compound_1859 FCCCNCCOc1cnc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.622 0.643 0.354 0.26 0.654 0.621 0.931 0.466 0.41 0.045 0.514 Compound_1860 FCCCN(CCOc1ncc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.57 0.762 0.176 0.305 0.54 0.674 0.988 0.44 0.238 0.549 0.458 Compound_1861 FCCCN1CC(C1)Nc1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.53 0.656 0.95 0.3 0.824 0.654 0.976 0.514 0.645 0.121 0.538 Compound_1862 FCCCN(CCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)F)C 0.515 0.747 0.755 0.408 0.871 0.676 0.979 0.838 0.36 0.468 0.71 Compound_1863 FCCCN1CC(C1)N(c1ccc(nc1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1)C 0.561 0.737 0.73 0.25 0.722 0.661 0.985 0.867 0.385 0.008 0.306 Compound_1864 FCCCN1CC(C1)Nc1ccc(c(c1)OCC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.592 0.637 0.967 0.321 0.836 0.654 0.976 0.708 0.511 0.51 0.61 Compound_1865 FCCCNCCOc1ccc(cc1)C1N(CC(CF)F)C(C)Cc2c1[nH]c1c2cccc1 0.492 0.566 0.133 0.29 0.865 0.73 0.95 0.291 0.312 0.384 0.556 Compound_1866 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(CF)F)C(C)Cc2c1[nH]c1c2cccc1 0.492 0.57 0.134 0.351 0.915 0.699 0.915 0.426 0.381 0.37 0.421 Compound_1867 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.453 0.478 0.305 0.518 0.957 0.69 0.201 0.795 0.185 0.811 0.5 Compound_1868 FCCCNCCOc1cc(F)c(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.475 0.562 0.216 0.272 0.923 0.674 0.915 0.734 0.421 0.255 0.548 Compound_1869 CC#CC(c1ccc(cc1)O)Cc1ccc(cc1)O 0.738 0.737 0.381 0.577 0.921 0.99 0.963 0.784 0.284 0.716 0.632 Compound_1870 FCCCNCCOc1ccnc(c1Cl)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.534 0.572 0.345 0.239 0.734 0.659 0.939 0.378 0.357 0.584 0.741 Compound_1871 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(CC)Cc2c1[nH]c1c2cccc1)F 0.505 0.66 0.597 0.288 0.865 0.674 0.986 0.446 0.367 0.279 0.6 Compound_1872 FCCCN(CCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.488 0.747 0.607 0.426 0.871 0.676 0.979 0.782 0.351 0.468 0.71 Compound_1873 FCCCNCCOc1ccc(cc1)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.446 0.566 0.142 0.24 0.892 0.708 0.915 0.33 0.313 0.384 0.556 Compound_1874 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.555 0.637 0.949 0.197 0.762 0.659 0.982 0.878 0.598 0.021 0.274 Compound_1875 FCCCNCCOc1ccnc(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.498 0.582 0.345 0.239 0.754 0.666 0.889 0.378 0.25 0.247 0.599 Compound_1876 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C1CCCC1 0.823 0.666 0.236 0.654 0.941 0.759 0.951 0.903 0.539 0.921 0.584 Compound_1877 FCCCN1CC(C1)Oc1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.608 0.666 0.718 0.348 0.841 0.659 0.955 0.577 0.582 0.049 0.467 Compound_1878 FCCCN1CC(C1)Nc1ccc(nc1F)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.576 0.637 0.978 0.226 0.791 0.661 0.982 0.789 0.603 0.021 0.274 Compound_1879 FCCCNCCOc1ncc(c(c1F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.622 0.703 0.271 0.304 0.664 0.666 0.892 0.417 0.415 0.153 0.419 Compound_1880 FCCCNCC(Oc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1)C 0.47 0.767 0.121 0.318 0.911 0.704 0.915 0.424 0.352 0.503 0.583 Compound_1881 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.452 0.57 0.143 0.291 0.932 0.694 0.915 0.442 0.382 0.37 0.421 Compound_1882 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.584 0.697 0.905 0.205 0.717 0.659 0.982 0.844 0.608 0.01 0.351 Compound_1883 FCCCN(CCOc1ccc(c(c1C(F)F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.484 0.747 0.353 0.437 0.929 0.662 0.979 0.7 0.351 0.468 0.71 Compound_1884 FCCCNCCOc1ccc(cc1)C1N(CC(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.419 0.621 0.09 0.275 0.826 0.737 0.291 0.474 0.318 0.336 0.594 Compound_1885 FCCCNCCOc1ncc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.574 0.694 0.094 0.26 0.531 0.674 0.984 0.504 0.302 0.316 0.281 Compound_1886 FCCCNCCOc1cnc(cn1)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.6 0.733 0.066 0.226 0.375 0.64 0.95 0.463 0.32 0.567 0.427 Compound_1887 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.552 0.627 0.941 0.205 0.687 0.664 0.983 0.774 0.392 0.017 0.306 Compound_1888 FCCCNCCOc1cc(F)c(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.557 0.603 0.278 0.285 0.936 0.667 0.934 0.307 0.313 0.093 0.593 Compound_1889 FCCCNCCOc1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.6 0.726 0.166 0.261 0.915 0.693 0.892 0.259 0.415 0.07 0.619 Compound_1890 FCCCN1CC(C1)Nc1cnc(cn1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.505 0.667 0.897 0.23 0.701 0.676 0.986 0.747 0.586 0.03 0.296 Compound_1891 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC2(CF)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.472 0.653 0.069 0.32 0.916 0.682 0.941 0.381 0.38 0.271 0.507 Compound_1892 CCNc1c(CN=O)ccc(c1c1ccccc1)c1ccccc1 0.491 0.616 0.879 0.646 0.476 0.882 0.945 0.233 0.536 0.89 0.775 Compound_1893 FC(CCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)F)F 0.505 0.669 0.664 0.292 0.927 0.662 0.986 0.362 0.354 0.31 0.478 Compound_1894 FCCCNCCOc1ccc(c(c1)F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.519 0.657 0.222 0.332 0.886 0.707 0.95 0.38 0.375 0.18 0.628 Compound_1895 COc1ccc(cc1C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OCCNCCC(F)(F)F 0.564 0.603 0.166 0.255 0.937 0.667 0.934 0.353 0.212 0.074 0.708 Compound_1896 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.494 0.653 0.073 0.352 0.912 0.671 0.899 0.429 0.381 0.271 0.507 Compound_1897 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C#N 0.547 0.562 0.33 0.296 0.922 0.67 0.874 0.389 0.354 0.219 0.833 Compound_1898 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1(C)N(CC(F)(C)C)C(Cc2c1ccc1c2cn[nH]1)C(F)F 0.609 0.748 0.769 0.428 0.845 0.665 0.976 0.721 0.502 0.635 0.495 Compound_1899 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C1CCC1 0.799 0.656 0.236 0.654 0.936 0.659 0.978 0.903 0.463 0.859 0.473 Compound_1900 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C(C)C)F 0.78 0.691 0.948 0.549 0.923 0.732 0.992 0.894 0.679 0.91 0.528 Compound_1901 FCCCN1CC(C1)Nc1ccc(nc1)C1c2ccc3c(c2CC(N1CC(F)(F)F)(C)C)cn[nH]3 0.529 0.662 0.872 0.203 0.747 0.659 0.982 0.708 0.386 0.009 0.389 Compound_1902 FCCCNCCOc1ncc(c(c1)OC)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.701 0.631 0.105 0.254 0.59 0.67 0.964 0.294 0.281 0.036 0.45 Compound_1903 FCCCNCCOc1ncc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.691 0.726 0.114 0.221 0.624 0.679 0.964 0.336 0.295 0.076 0.416 Compound_1904 FCCCN1CC(C1)Oc1ccc(nc1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.644 0.626 0.82 0.209 0.662 0.65 0.937 0.919 0.366 0.157 0.449 Compound_1905 Oc1ccc2c(c1)SC(C2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.512 0.428 0.144 0.555 0.947 0.788 0.475 0.747 0.257 0.956 0.912 Compound_1906 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(Cc2c1ccc1c2cn[nH]1)C(F)F 0.594 0.628 0.548 0.406 0.854 0.659 0.978 0.638 0.491 0.049 0.441 Compound_1907 CCC(=Cc1ccc(cc1)O)c1ccc(cc1)O 0.827 0.841 0.322 0.627 0.927 0.98 0.8 0.98 0.828 0.957 0.973 Compound_1908 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(Cc2c1[nH]c1c2cccc1)C(F)F)F 0.536 0.666 0.523 0.278 0.927 0.662 0.986 0.434 0.365 0.041 0.333 Compound_1909 Oc1ccc2c(c1)OC(C(=C2)c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCCC1 0.591 0.743 0.087 0.595 0.941 0.773 0.15 0.553 0.294 0.895 0.621 Compound_1910 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.479 0.669 0.542 0.288 0.865 0.674 0.986 0.434 0.366 0.31 0.478 Compound_1911 FCCCNCCNc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.55 0.507 0.424 0.244 0.922 0.73 0.958 0.3 0.137 0.057 0.819 Compound_1912 FCCCNCCOc1cnc(cn1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.601 0.662 0.306 0.246 0.437 0.627 0.947 0.287 0.214 0.189 0.481 Compound_1913 FCCCN1CC(C1)Nc1cnc(c(c1)F)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.579 0.627 0.98 0.205 0.74 0.657 0.946 0.635 0.473 0.01 0.397 Compound_1914 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.567 0.637 0.981 0.224 0.671 0.656 0.946 0.38 0.262 0.006 0.446 Compound_1915 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.533 0.633 0.928 0.211 0.664 0.665 0.956 0.816 0.393 0.104 0.34 Compound_1916 FCCCN1CC(C1)Oc1ccc(nc1)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.65 0.623 0.927 0.238 0.662 0.649 0.947 0.578 0.331 0.041 0.521 Compound_1917 COc1cc(ccc1C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1)NC1CN(C1)CCC(F)(F)F 0.533 0.626 0.95 0.295 0.85 0.651 0.976 0.479 0.563 0.153 0.545 Compound_1918 O=NCc1c(O)ccc(c1Cl)c1ccc(cc1)O 0.765 0.611 0.804 0.717 0.873 0.881 0.078 0.983 0.811 0.229 0.816 Compound_1919 FC(C1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1)F 0.577 0.688 0.274 0.414 0.854 0.659 0.978 0.656 0.48 0.732 0.457 Compound_1920 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(Cl)ccc2c2c1c1ccc(cc1nc2)O 0.516 0.609 0.787 0.602 0.928 0.641 0.626 0.948 0.45 0.626 0.673 Compound_1921 FCCCNCCOc1ccc(cc1)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.486 0.657 0.079 0.281 0.885 0.709 0.95 0.275 0.329 0.18 0.628 Compound_1922 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc(o1)C)c1ccccc1C(C)C 0.849 0.744 0.926 0.789 0.807 0.665 0.979 0.972 0.501 0.947 0.657 Compound_1923 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1OC(F)(F)F 0.872 0.657 0.809 0.692 0.929 0.735 0.88 0.818 0.576 0.955 0.848 Compound_1924 FCCCNCCOc1ccc(c(c1C(F)F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.481 0.639 0.332 0.27 0.927 0.662 0.986 0.377 0.366 0.072 0.301 Compound_1925 FCCCNCCNc1ncc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.609 0.585 0.807 0.291 0.589 0.71 0.963 0.383 0.083 0.125 0.768 Compound_1926 FCCCNCCOc1cc(F)c(c(c1)F)C1N(CC(COC)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.494 0.642 0.215 0.292 0.941 0.704 0.941 0.378 0.385 0.052 0.689 Compound_1927 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.573 0.697 0.908 0.224 0.714 0.662 0.983 0.673 0.414 0.01 0.351 Compound_1928 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(c3c1c1ccc(cc1nc3)O)cccc2C(F)(F)F 0.448 0.579 0.693 0.585 0.972 0.608 0.933 0.941 0.322 0.448 0.711 Compound_1929 FCCCNCCOc1ccnc(c1F)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.525 0.63 0.745 0.224 0.76 0.66 0.948 0.176 0.219 0.225 0.566 Compound_1930 FCC1CN(C1)CCOc1ccc(cc1)C1(C)N(CC2(F)COC2)C(C)Cc2c1ccc1c2cn[nH]1 0.59 0.718 0.792 0.415 0.77 0.667 0.971 0.764 0.472 0.105 0.542 Compound_1931 FCC1CCN(C1)CC(Oc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1)C 0.427 0.591 0.548 0.357 0.96 0.903 0.085 0.75 0.289 0.715 0.388 Compound_1932 FCCCN1CC(C1)Nc1ccc(nc1)C1N(CC(F)F)C(Cc2c1ccc1c2cn[nH]1)C(F)F 0.557 0.58 0.977 0.225 0.767 0.66 0.975 0.716 0.41 0.014 0.311 Compound_1933 FC(CCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)F 0.479 0.669 0.542 0.258 0.892 0.671 0.986 0.434 0.35 0.31 0.478 Compound_1934 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1C 0.914 0.442 0.193 0.781 0.828 0.718 0.922 0.934 0.436 0.177 0.533 Compound_1935 FCCCNCCOc1ccc(c(n1)OC)C1N(CC(F)(F)C)C(C)Cc2c1[nH]c1c2cccc1 0.671 0.7 0.656 0.291 0.823 0.704 0.932 0.908 0.311 0.541 0.551 Compound_1936 CCCCCSCCCN(CCCCCCC(=C(c1ccc(cc1)O)CC)c1ccc(cc1)O)C 0.606 0.583 0.069 0.339 0.788 0.967 0.007 0.549 0.438 0.512 0.739 Compound_1937 FCCCN1CC(C1)Nc1ccc(nc1)C1c2ccc3c(c2CC(N1CC(F)F)(C)C)cn[nH]3 0.537 0.692 0.916 0.203 0.687 0.66 0.982 0.79 0.431 0.005 0.375 Compound_1938 FCC1CCN(C1)CCNc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccccc1 0.537 0.481 0.884 0.29 0.982 0.972 0.07 0.43 0.252 0.237 0.647 Compound_1939 FCCCNCCOc1ccc(cc1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.505 0.653 0.072 0.31 0.874 0.689 0.941 0.328 0.319 0.271 0.507 Compound_1940 C#Cc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.926 0.415 0.199 0.861 0.802 0.716 0.959 0.823 0.47 0.364 0.562 Compound_1941 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1cccc2c1cccc2 0.947 0.415 0.173 0.771 0.882 0.748 0.953 0.891 0.524 0.364 0.674 Compound_1942 FCCCNCCOc1cc(c(cc1F)OC)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.569 0.603 0.269 0.275 0.936 0.667 0.934 0.456 0.327 0.093 0.593 Compound_1943 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)OCC 0.555 0.699 0.378 0.581 0.978 0.769 0.046 0.975 0.155 0.686 0.646 Compound_1944 FCCCNCCOc1ccc(c(c1)F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.533 0.653 0.208 0.352 0.876 0.688 0.941 0.409 0.356 0.271 0.507 Compound_1945 FCCCNCCNc1cnc(cn1)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.494 0.62 0.22 0.213 0.484 0.778 0.951 0.435 0.137 0.053 0.235 Compound_1946 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2O)C 0.97 0.991 0.009 0.489 0.991 0.99 0.02 0.286 0.049 0.998 0.918 Compound_1947 FCCCNCCOc1cccc(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.482 0.562 0.234 0.264 0.923 0.674 0.915 0.31 0.285 0.255 0.548 Compound_1948 FCCCN(CCOc1ccc(c(c1C)C1c2[nH]c3c(c2CC(N1CC(C(=O)O)C)C(F)(F)F)cccc3)F)C 0.544 0.776 0.607 0.436 0.929 0.662 0.979 0.764 0.339 0.638 0.789 Compound_1949 FCCCNCCNc1ncc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.578 0.494 0.456 0.219 0.557 0.714 0.948 0.441 0.132 0.306 0.646 Compound_1950 FCCCNCCOc1cnc(cn1)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.599 0.662 0.1 0.217 0.417 0.631 0.914 0.524 0.299 0.318 0.398 Compound_1951 FCCCN(CCOc1ccc(c(c1F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.505 0.688 0.557 0.513 0.905 0.668 0.949 0.69 0.511 0.142 0.628 Compound_1952 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)SCCN1CCCCC1)c1ccc(cc1)O 0.686 0.485 0.199 0.879 0.817 0.742 0.72 0.854 0.478 0.129 0.542 Compound_1953 FCCCNCCOc1ncc(c(c1Cl)C1N(CC(C(=O)O)C)C(Cc2c1[nH]c1c2cccc1)C(F)F)F 0.637 0.609 0.048 0.248 0.725 0.648 0.973 0.448 0.353 0.183 0.258 Compound_1954 CCc1c(c2ccc(cc2)O)c2n3c1cc(O)cc3cc2 0.638 0.731 0.377 0.727 0.926 0.735 0.866 0.973 0.836 0.395 0.896 Compound_1955 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.548 0.638 0.562 0.413 0.818 0.667 0.978 0.717 0.467 0.391 0.403 Compound_1956 CCc1c(c2ccc(cc2)O)c2n3c1ccc(c3cc2)O 0.492 0.718 0.346 0.752 0.783 0.682 0.862 0.982 0.733 0.466 0.864 Compound_1957 FCCCN1CC(C1)Nc1ccc(nc1)C1(C)N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.553 0.702 0.84 0.26 0.687 0.66 0.982 0.845 0.413 0.004 0.412 Compound_1958 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(C)cccc2c2c1c1ccc(cc1nc2)O 0.416 0.622 0.761 0.584 0.939 0.656 0.699 0.94 0.392 0.411 0.592 Compound_1959 FC(CCNCCOc1ccc(cc1)C1N(CC(C)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.419 0.62 0.09 0.249 0.895 0.727 0.96 0.474 0.278 0.336 0.528 Compound_1960 FCCCNCCOc1ncc(c(c1Cl)C1c2[nH]c3c(c2CC(N1CC(C(=O)O)C)C(F)(F)F)cccc3)F 0.638 0.608 0.033 0.265 0.725 0.648 0.973 0.403 0.344 0.204 0.366 Compound_1961 FCCCNCCOc1nnc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.636 0.698 0.143 0.247 0.831 0.678 0.954 0.308 0.426 0.035 0.391 Compound_1962 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1ccc(c2)O)c1ccc(cc1)F 0.489 0.453 0.403 0.546 0.964 0.666 0.9 0.841 0.47 0.809 0.438 Compound_1963 FCCCNCCOc1ccc(c(c1Cl)C1c2[nH]c3c(c2CC(N1CC(C(=O)O)C)C(F)(F)F)cccc3)F 0.588 0.619 0.27 0.319 0.895 0.654 0.974 0.341 0.371 0.2 0.529 Compound_1964 FCC1CN(C1)CCOc1ccc(cc1)C1(C)N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.587 0.738 0.599 0.418 0.817 0.663 0.976 0.716 0.504 0.054 0.558 Compound_1965 FCCCNCCOc1nccc(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1 0.586 0.695 0.081 0.248 0.428 0.678 0.746 0.423 0.302 0.319 0.528 Compound_1966 FCCCNCCNc1ncc(c(c1)OC)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.621 0.613 0.266 0.257 0.589 0.688 0.971 0.273 0.136 0.166 0.586 Compound_1967 OC1=CCC2C(=C1)CCC1C2CCC2(C1CCC2O)C 0.938 1.0 0.084 0.682 0.979 0.957 0.01 0.993 0.333 0.992 0.367 Compound_1968 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C(F)(F)F)C(F)(F)F 0.89 0.657 0.927 0.617 0.933 0.734 0.963 0.963 0.679 0.955 0.848 Compound_1969 C#CCN(C1CCc2c1cc1c(c2)nc([nH]c1=O)CO)c1ccc(cc1)C(=O)NC(C(=O)O)CCC(=O)NC(C(=O)O)CCC(=O)O 0.694 0.546 0.549 0.348 0.526 0.552 0.593 0.202 0.4 0.45 0.434 Compound_1970 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)nc(o2)C 0.482 0.721 0.926 0.599 0.815 0.645 0.977 0.987 0.202 0.664 0.373 Compound_1971 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(c(c1)C)O 0.921 0.464 0.28 0.854 0.777 0.739 0.934 0.878 0.454 0.862 0.877 Compound_1972 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)OCCO2 0.441 0.646 0.358 0.535 0.919 0.628 0.137 0.974 0.26 0.957 0.404 Compound_1973 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1F)OCC 0.64 0.765 0.6 0.521 0.924 0.769 0.778 0.984 0.126 0.344 0.445 Compound_1974 FCCCN(CCOc1ncc(c(c1C)C1N(CCC(=O)O)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.57 0.734 0.146 0.288 0.532 0.672 0.988 0.462 0.272 0.549 0.425 Compound_1975 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1)OC 0.481 0.661 0.5 0.502 0.949 0.838 0.081 0.946 0.128 0.152 0.315 Compound_1976 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)OC 0.555 0.661 0.344 0.521 0.974 0.754 0.046 0.925 0.28 0.263 0.565 Compound_1977 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1=CCC(CC1)(F)F 0.696 0.64 0.8 0.466 0.951 0.799 0.916 0.892 0.279 0.664 0.469 Compound_1978 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(nc1F)OCC 0.607 0.765 0.382 0.522 0.924 0.769 0.778 0.986 0.202 0.344 0.445 Compound_1979 FCCCNCCOc1ccc(c(c1C)C1c2[nH]c3c(c2CC(N1CC(C(=O)O)C)C(F)(F)F)cccc3)F 0.535 0.705 0.542 0.288 0.927 0.662 0.986 0.441 0.36 0.024 0.438 Compound_1980 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1F)F)N1CCCCC1 0.677 0.631 0.076 0.572 0.993 0.883 0.97 0.981 0.426 0.796 0.436 Compound_1981 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc2c(c1)CC(N2)(C)C 0.699 0.74 0.023 0.365 0.956 0.936 0.992 0.942 0.432 0.379 0.514 Compound_1982 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1C)OCC 0.491 0.636 0.311 0.58 0.971 0.834 0.802 0.981 0.239 0.349 0.51 Compound_1983 FCCCNCCOc1ccc(c(c1F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)Cl 0.518 0.629 0.27 0.319 0.87 0.679 0.984 0.333 0.247 0.144 0.437 Compound_1984 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)CC(O2)(C)C 0.689 0.743 0.108 0.534 0.955 0.859 0.139 0.978 0.29 0.148 0.354 Compound_1985 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)ncn2C 0.57 0.675 0.215 0.624 0.832 0.747 0.913 0.948 0.166 0.419 0.467 Compound_1986 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)(C)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.471 0.797 0.483 0.309 0.869 0.676 0.986 0.424 0.384 0.521 0.476 Compound_1987 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)nco2 0.46 0.693 0.777 0.585 0.755 0.636 0.979 0.964 0.207 0.679 0.529 Compound_1988 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1c2ccc3c(c2CC(N1CC(F)(C)C)(C)C)cn[nH]3 0.579 0.688 0.531 0.416 0.828 0.666 0.978 0.667 0.484 0.732 0.457 Compound_1989 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccnc(c1)OC 0.518 0.731 0.443 0.485 0.721 0.644 0.046 0.928 0.39 0.225 0.331 Compound_1990 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1)OC 0.603 0.731 0.645 0.486 0.721 0.644 0.046 0.914 0.069 0.225 0.331 Compound_1991 FCCCN(CCOc1nccc(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)C 0.582 0.753 0.112 0.305 0.438 0.679 0.739 0.29 0.238 0.552 0.704 Compound_1992 FCCCN1CC(C1)Nc1cnc(cn1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.531 0.697 0.816 0.239 0.715 0.672 0.986 0.617 0.609 0.021 0.311 Compound_1993 Oc1ccc2c(c1)CCC1C2C(CC2(C1CCC2O)C)c1ccc(cc1)OCCOCCOCCn1nnc(c1)C=Nc1cc(O)c2c(c1O)cccc2 0.604 0.829 0.911 0.489 0.912 0.705 0.87 0.851 0.332 0.215 0.559 Compound_1994 FCCCNCCOc1ccc(c(c1C)C1N(CCC(=O)O)C(C)Cc2c1[nH]c1c2cccc1)F 0.479 0.659 0.542 0.304 0.861 0.672 0.986 0.456 0.386 0.072 0.393 Compound_1995 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc([nH]1)C)c1ccccc1C(C)C 0.771 0.742 0.932 0.755 0.7 0.667 0.916 0.91 0.649 0.863 0.791 Compound_1996 O=NCc1ccc(c(c1O)c1ccccc1)c1ccccc1 0.639 0.586 0.347 0.695 0.787 0.974 0.725 0.932 0.634 0.089 0.527 Compound_1997 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C1COC1 0.754 0.601 0.635 0.634 0.916 0.698 0.991 0.892 0.546 0.959 0.694 Compound_1998 FCCCNCCOc1ccnc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.498 0.572 0.27 0.25 0.745 0.667 0.889 0.396 0.337 0.213 0.697 Compound_1999 FCCCNCCOc1ccc(c(c1Cl)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)Cl 0.527 0.629 0.27 0.319 0.73 0.67 0.659 0.333 0.394 0.144 0.437 Compound_2000 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(CF)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.584 0.676 0.914 0.414 0.842 0.664 0.974 0.549 0.591 0.688 0.555 Compound_2001 FCC1CN(C1)CCNc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.494 0.672 0.833 0.21 0.812 0.657 0.973 0.541 0.536 0.064 0.306 Compound_2002 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2c(F)cccc2c2c1c1ccc(cc1nc2)O 0.497 0.621 0.755 0.572 0.96 0.645 0.935 0.934 0.425 0.649 0.594 Compound_2003 Oc1ccc2c(c1)ccc(c2Cc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)S(=O)(=O)C 0.248 0.578 0.442 0.686 0.828 0.806 0.103 0.919 0.37 0.47 0.15 Compound_2004 FCCCNCCOc1ccc(c(n1)OC)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.673 0.65 0.492 0.243 0.823 0.692 0.885 0.87 0.318 0.119 0.404 Compound_2005 FCCCNCCOc1ccnc(c1F)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.505 0.58 0.454 0.198 0.754 0.666 0.889 0.425 0.299 0.374 0.481 Compound_2006 FCCCN(CCOc1ccc(c(c1C)C1N(CCC(=O)O)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.488 0.709 0.554 0.459 0.867 0.673 0.979 0.812 0.399 0.468 0.674 Compound_2007 FCCCNCCOc1ccc(c(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.495 0.582 0.234 0.269 0.926 0.685 0.874 0.402 0.299 0.141 0.518 Compound_2008 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.57 0.688 0.562 0.426 0.843 0.664 0.978 0.631 0.482 0.732 0.457 Compound_2009 FCCCN(CCOc1ncc(c(c1C)C1N(CCC(=O)O)C(C)Cc2c1[nH]c1c2cc(cc1)F)F)C 0.588 0.734 0.546 0.326 0.532 0.672 0.988 0.605 0.301 0.549 0.425 Compound_2010 FCCCNCCOc1ccc(c(c1C)C1N(CC(C(=O)O)(F)F)C(C)Cc2c1[nH]c1c2cccc1)F 0.51 0.739 0.542 0.329 0.925 0.647 0.974 0.423 0.416 0.042 0.492 Compound_2011 FCCCNCCOc1ccc(nc1)C1N(CC(F)(C)C)C(C)Cc2c1[nH]c1c2cccc1 0.575 0.708 0.237 0.226 0.427 0.631 0.949 0.593 0.312 0.614 0.65 Compound_2012 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1cccc(c1C(F)(F)F)F 0.902 0.616 0.797 0.647 0.935 0.712 0.959 0.938 0.641 0.969 0.872 Compound_2013 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(F)ccc2c2c1c1ccc(cc1nc2)O 0.544 0.609 0.787 0.602 0.96 0.645 0.935 0.948 0.444 0.563 0.572 Compound_2014 FCC1CN(C1)CCOc1ccc(nc1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.653 0.696 0.788 0.332 0.674 0.652 0.972 0.869 0.383 0.106 0.524 Compound_2015 Oc1ccc2c(c1)SC(C(O2)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1O 0.484 0.528 0.232 0.5 0.855 0.666 0.064 0.354 0.252 0.937 0.854 Compound_2016 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.595 0.616 0.964 0.403 0.852 0.663 0.974 0.66 0.591 0.635 0.537 Compound_2017 FCCCNCCOc1ccc(c(c1Cl)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)Cl 0.559 0.629 0.382 0.36 0.758 0.664 0.974 0.274 0.401 0.144 0.437 Compound_2018 FCC1CN(C1)CCOc1cc(F)c(c(c1)OC)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.631 0.606 0.967 0.438 0.865 0.662 0.974 0.631 0.62 0.632 0.492 Compound_2019 FCCCNCCOc1cccc(c1C#N)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.553 0.572 0.271 0.255 0.905 0.662 0.908 0.376 0.348 0.24 0.833 Compound_2020 CCCCCS(=O)(=O)CCCCCCCCCCn1c(c2ccc(cc2)O)c(c2c1ccc(c2)O)C 0.694 0.722 0.573 0.661 0.897 0.926 0.642 0.992 0.407 0.606 0.474 Compound_2021 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2(O)C#Cc1ccc(cc1)[N+](C)(C)C)C 0.873 0.866 0.002 0.359 0.996 0.991 0.846 0.069 0.191 0.745 0.829 Compound_2022 CN(Cc1ccccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.725 0.613 0.685 0.499 0.827 0.715 0.886 0.895 0.55 0.688 0.291 Compound_2023 FCC1CN(C1)CCOc1ccc(cc1)C1N(CC2(F)COC2)C(C)Cc2c1ccc1c2cn[nH]1 0.563 0.723 0.803 0.387 0.777 0.665 0.974 0.723 0.401 0.185 0.5 Compound_2024 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1(C)N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.6 0.748 0.779 0.449 0.834 0.666 0.976 0.715 0.492 0.635 0.495 Compound_2025 FCCCNCCOc1ncc(c(c1Cl)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.598 0.643 0.033 0.258 0.607 0.652 0.973 0.448 0.354 0.147 0.253 Compound_2026 FCCCNC(COc1ccc(cc1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1)C 0.49 0.628 0.136 0.273 0.874 0.689 0.941 0.28 0.306 0.047 0.555 Compound_2027 FCC1CN(C1)CCOc1ccc(cc1)C1Oc2cc(C)ccc2c2c1c1ccc(cc1nc2)O 0.456 0.603 0.896 0.605 0.941 0.675 0.636 0.95 0.397 0.325 0.571 Compound_2028 FCCCN1CC(C1)Oc1cnc(c(c1)F)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.632 0.623 0.931 0.242 0.713 0.649 0.947 0.272 0.44 0.052 0.481 Compound_2029 OC(=O)CCc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.722 0.661 0.63 0.488 0.905 0.726 0.986 0.82 0.287 0.228 0.083 Compound_2030 FCCCNCCOc1cc(F)c(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.574 0.603 0.292 0.313 0.936 0.667 0.934 0.483 0.311 0.093 0.593 Compound_2031 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)CC 0.505 0.583 0.358 0.317 0.926 0.699 0.925 0.357 0.249 0.593 0.755 Compound_2032 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.505 0.582 0.247 0.311 0.927 0.686 0.874 0.399 0.348 0.119 0.648 Compound_2033 FCCCNCCOc1ccc(c(c1Cl)C1N(CC(C(=O)O)C)C(Cc2c1[nH]c1c2cccc1)C(F)F)F 0.586 0.597 0.255 0.309 0.895 0.654 0.974 0.333 0.376 0.179 0.41 Compound_2034 FCCCNCCOc1ccc(c(c1C)C1c2[nH]c3c(c2CC(N1CC(C(=O)O)C)(C)C)cccc3)F 0.475 0.797 0.391 0.329 0.836 0.685 0.986 0.498 0.376 0.521 0.476 Compound_2035 FCCCNCCOc1cccc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.453 0.552 0.122 0.291 0.923 0.675 0.915 0.298 0.201 0.219 0.665 Compound_2036 FCCCNCCNc1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.586 0.661 0.419 0.259 0.927 0.694 0.971 0.34 0.217 0.055 0.78 Compound_2037 FCCCNCCOc1ncc(c(c1)C)C1N(CC(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.623 0.67 0.085 0.24 0.5 0.68 0.915 0.447 0.336 0.191 0.338 Compound_2038 FCC1CN(C1)CCOc1ccc(nc1)C1N(CC(F)(F)C)C(C)Cc2c1ccc1c2cn[nH]1 0.638 0.673 0.967 0.328 0.668 0.651 0.972 0.903 0.378 0.098 0.522 Compound_2039 FCCCNCCNc1ncc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.575 0.502 0.347 0.252 0.613 0.611 0.861 0.415 0.345 0.193 0.658 Compound_2040 FCCCNCCOc1ccc(c(c1F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.473 0.639 0.27 0.319 0.894 0.677 0.987 0.333 0.378 0.072 0.301 Compound_2041 FCC1CN(C1)CCOc1ccc(cc1)C1N(CC(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.52 0.639 0.831 0.375 0.801 0.667 0.632 0.793 0.402 0.406 0.458 Compound_2042 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(CF)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.59 0.626 0.988 0.403 0.868 0.661 0.974 0.661 0.594 0.043 0.525 Compound_2043 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1c2ccc3c(c2CC(N1CC(C)C)(C)C)cn[nH]3 0.557 0.688 0.531 0.412 0.8 0.669 0.978 0.748 0.463 0.732 0.457 Compound_2044 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)OC(F)F 0.496 0.598 0.466 0.524 0.983 0.829 0.874 0.964 0.226 0.507 0.384 Compound_2045 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(cc1C)OCC 0.596 0.674 0.475 0.533 0.713 0.677 0.024 0.95 0.164 0.218 0.588 Compound_2046 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)OC(O2)(F)F 0.647 0.604 0.348 0.526 0.978 0.716 0.92 0.969 0.174 0.877 0.411 Compound_2047 OC1CCC(CC1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.759 0.46 0.211 0.591 0.792 0.744 0.346 0.612 0.423 0.96 0.78 Compound_2048 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc2c1cc[nH]2 0.614 0.534 0.835 0.468 0.892 0.692 0.866 0.958 0.187 0.905 0.769 Compound_2049 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnoc1C 0.524 0.633 0.419 0.525 0.875 0.66 0.189 0.917 0.284 0.574 0.563 Compound_2050 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)CC(N2C(=O)C)(C)C 0.791 0.811 0.381 0.542 0.97 0.937 0.791 0.978 0.583 0.895 0.431 Compound_2051 COc1cc(O)ccc1c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.922 0.448 0.304 0.821 0.86 0.72 0.974 0.849 0.517 0.424 0.843 Compound_2052 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)OC 0.495 0.661 0.283 0.524 0.949 0.838 0.081 0.947 0.278 0.152 0.315 Compound_2053 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.591 0.586 0.921 0.365 0.852 0.66 0.974 0.652 0.6 0.097 0.487 Compound_2054 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1)OCC 0.594 0.761 0.414 0.526 0.652 0.638 0.046 0.956 0.034 0.358 0.5 Compound_2055 FCCCNCCOc1nccc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.575 0.638 0.023 0.28 0.674 0.672 0.892 0.325 0.387 0.188 0.471 Compound_2056 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1cccc(c1Cl)F 0.575 0.621 0.671 0.447 0.989 0.77 0.577 0.983 0.319 0.836 0.615 Compound_2057 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(c2c1cccc2)O 0.947 0.338 0.173 0.791 0.858 0.74 0.932 0.885 0.511 0.967 0.918 Compound_2058 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1F)C 0.483 0.602 0.417 0.532 0.959 0.858 0.833 0.961 0.319 0.685 0.258 Compound_2059 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1C)O 0.92 0.365 0.277 0.798 0.82 0.704 0.894 0.969 0.467 0.878 0.856 Compound_2060 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)O 0.57 0.589 0.344 0.542 0.971 0.727 0.714 0.953 0.298 0.698 0.481 Compound_2061 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1)OCC 0.468 0.689 0.536 0.547 0.961 0.862 0.081 0.974 0.072 0.546 0.459 Compound_2062 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)NCCN1CCCCC1)c1ccc(cc1)O 0.667 0.42 0.329 0.691 0.902 0.759 0.801 0.862 0.501 0.005 0.49 Compound_2063 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)nsn2 0.652 0.608 0.619 0.59 0.95 0.695 0.807 0.977 0.206 0.836 0.507 Compound_2064 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1Cl)Cl 0.544 0.621 0.491 0.493 0.992 0.802 0.564 0.972 0.337 0.836 0.615 Compound_2065 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C(F)(F)F)OC 0.528 0.642 0.321 0.524 0.99 0.808 0.874 0.959 0.14 0.088 0.468 Compound_2066 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)C(=O)O)c1ccc(cc1Cl)F 0.426 0.628 0.245 0.369 0.98 0.872 0.953 0.857 0.545 0.612 0.534 Compound_2067 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1F)F)OCC 0.519 0.682 0.31 0.568 0.971 0.834 0.802 0.99 0.206 0.53 0.43 Compound_2068 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)OC(F)F 0.548 0.592 0.344 0.532 0.988 0.696 0.81 0.955 0.255 0.62 0.373 Compound_2069 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)COC 0.55 0.592 0.303 0.296 0.946 0.689 0.89 0.26 0.278 0.066 0.707 Compound_2070 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1CCOCC1 0.655 0.653 0.613 0.51 0.858 0.732 0.045 0.933 0.242 0.666 0.386 Compound_2071 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1C)C 0.643 0.582 0.608 0.493 0.951 0.894 0.149 0.972 0.21 0.5 0.371 Compound_2072 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cco2 0.404 0.643 0.842 0.555 0.648 0.858 0.893 0.949 0.128 0.541 0.45 Compound_2073 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(cc1C)OC 0.588 0.674 0.634 0.496 0.728 0.647 0.024 0.917 0.275 0.083 0.437 Compound_2074 FCCCNCCN(c1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.492 0.632 0.199 0.291 0.833 0.694 0.993 0.468 0.247 0.092 0.264 Compound_2075 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C#N)OC 0.589 0.671 0.481 0.524 0.979 0.598 0.143 0.95 0.395 0.196 0.653 Compound_2076 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2(O)C#Cc1cccc(c1)C(=O)O)C 0.769 0.953 0.008 0.304 0.994 0.991 0.198 0.266 0.256 0.996 0.658 Compound_2077 CCCC(c1ccc(cc1)O)Cc1ccc(cc1)O 0.668 0.641 0.191 0.517 0.949 0.966 0.963 0.892 0.442 0.966 0.829 Compound_2078 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1F)F)OC 0.525 0.644 0.28 0.508 0.963 0.808 0.802 0.958 0.31 0.155 0.318 Compound_2079 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)F)OCC 0.547 0.765 0.534 0.536 0.723 0.57 0.778 0.954 0.335 0.344 0.445 Compound_2080 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)OC 0.554 0.644 0.344 0.521 0.963 0.808 0.802 0.925 0.312 0.155 0.318 Compound_2081 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)OCC 0.548 0.682 0.378 0.581 0.971 0.834 0.802 0.975 0.184 0.53 0.43 Compound_2082 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1F)OC 0.649 0.715 0.774 0.481 0.946 0.778 0.778 0.971 0.236 0.229 0.3 Compound_2083 FCC1CN(C1)CCOc1cnc(c(c1)F)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.61 0.636 0.924 0.358 0.718 0.652 0.972 0.763 0.466 0.16 0.5 Compound_2084 CCC(=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C)C(=O)O 0.759 0.724 0.253 0.659 0.924 0.739 0.992 0.909 0.349 0.98 0.878 Compound_2085 O=NCc1ccc(c(c1N)c1ccccc1)c1ccccc1 0.797 0.708 0.914 0.72 0.666 0.954 0.988 0.669 0.667 0.391 0.786 Compound_2086 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC2(F)COC2)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.577 0.723 0.63 0.421 0.81 0.672 0.974 0.605 0.466 0.185 0.5 Compound_2087 FCC1CN(C1)CCOc1ccc(nc1)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.628 0.636 0.92 0.353 0.715 0.651 0.972 0.889 0.355 0.135 0.541 Compound_2088 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)F 0.957 0.409 0.352 0.746 0.842 0.737 0.96 0.835 0.539 0.488 0.637 Compound_2089 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(c(c1)Cl)O 0.931 0.421 0.156 0.78 0.863 0.687 0.859 0.84 0.477 0.98 0.962 Compound_2090 FCCCNCCOc1ccc(c(c1F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cc(cc1)F)F 0.505 0.639 0.382 0.36 0.928 0.653 0.978 0.274 0.38 0.072 0.301 Compound_2091 FCCCNCCOc1ccc(c(c1Cl)C1N(CC(C(=O)O)(C)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.523 0.731 0.226 0.325 0.87 0.665 0.984 0.323 0.391 0.722 0.511 Compound_2092 FCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)OCCN1CC(C1)CF)ccc1c2cn[nH]1)F 0.593 0.586 0.94 0.405 0.842 0.664 0.974 0.644 0.6 0.097 0.487 Compound_2093 Fc1cccc(c1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.948 0.409 0.461 0.708 0.842 0.737 0.96 0.808 0.495 0.488 0.637 Compound_2094 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1 0.947 0.415 0.173 0.822 0.846 0.747 0.95 0.805 0.489 0.364 0.674 Compound_2095 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)C1CCCCC1 0.72 0.503 0.446 0.643 0.83 0.768 0.565 0.794 0.524 0.374 0.715 Compound_2096 COC1CC2(C)C(C3C1c1ccc(cc1CC3)O)CCC2(O)C#C 0.945 0.913 0.022 0.406 0.972 0.951 0.013 0.233 0.152 0.971 0.912 Compound_2097 FCCCNCCOc1ccc(cn1)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.634 0.693 0.063 0.244 0.522 0.682 0.951 0.662 0.189 0.134 0.447 Compound_2098 FCCCNCC(Oc1ccc(c(c1)C1N(CC(CO)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC)C 0.594 0.688 0.636 0.24 0.895 0.667 0.905 0.326 0.134 0.348 0.864 Compound_2099 FCCCNCCOc1ccc(c(c1C)C1N(CC2(CCC2)C(=O)O)C(C)Cc2c1[nH]c1c2cccc1)F 0.52 0.748 0.757 0.339 0.913 0.653 0.986 0.449 0.378 0.042 0.532 Compound_2100 FCC1CN(C1)CCOc1cc(F)c(c(c1)F)C1N(CC(C)C)C(C)Cc2c1ccc1c2c(F)n[nH]1 0.536 0.638 0.672 0.423 0.871 0.678 0.978 0.731 0.467 0.391 0.403 Compound_2101 FCC1CN(C1)CCOc1cc(F)c(c(c1)OC)C1N(CC(CF)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.626 0.606 0.989 0.438 0.866 0.659 0.974 0.632 0.623 0.055 0.482 Compound_2102 COC(=O)C(c1ccc(cc1)O)Cc1ccc(cc1)O 0.306 0.69 0.593 0.607 0.928 0.913 0.992 0.29 0.207 0.189 0.473 Compound_2103 O=C(OC(C)(C)C)NCc1ccc(cc1)C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.735 0.773 0.003 0.324 0.933 0.985 0.526 0.282 0.249 0.175 0.5 Compound_2104 FCC(CN1C(C)Cc2c(C1c1c(F)cc(cc1F)OCCN1CC(C1)CF)ccc1c2cn[nH]1)F 0.575 0.636 0.653 0.443 0.843 0.66 0.978 0.718 0.478 0.172 0.441 Compound_2105 OC(=O)C=Cc1ccc(cc1)Nc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.786 0.769 0.371 0.568 0.91 0.755 0.997 0.93 0.689 0.895 0.524 Compound_2106 FCC1CN(C1)CCOc1ccc(c(c1)C#N)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.664 0.676 0.79 0.422 0.818 0.652 0.967 0.736 0.521 0.106 0.662 Compound_2107 COc1cc(OCCN2CC(C2)C)ccc1C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.56 0.711 0.914 0.415 0.827 0.665 0.742 0.579 0.606 0.584 0.545 Compound_2108 COCC(CN1C(C)Cc2c(C1c1ccc(cn1)NC1CN(C1)CCCF)ccc1c2cn[nH]1)(F)F 0.58 0.663 0.972 0.238 0.683 0.663 0.981 0.758 0.353 0.009 0.543 Compound_2109 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.583 0.596 0.914 0.419 0.868 0.658 0.974 0.644 0.526 0.049 0.537 Compound_2110 Oc1ccc(cc1)CC(C(F)(F)F)c1ccc(cc1)O 0.686 0.665 0.459 0.65 0.972 0.913 0.997 0.873 0.173 0.817 0.955 Compound_2111 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)OCCF 0.553 0.661 0.388 0.517 0.98 0.874 0.8 0.966 0.238 0.738 0.422 Compound_2112 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)C(C)C 0.754 0.565 0.343 0.622 0.779 0.744 0.297 0.839 0.478 0.168 0.418 Compound_2113 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)C 0.54 0.619 0.604 0.533 0.967 0.846 0.093 0.957 0.281 0.808 0.5 Compound_2114 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)SC(F)F 0.475 0.564 0.283 0.544 0.958 0.778 0.852 0.974 0.248 0.852 0.588 Compound_2115 BrCCCCC1CC2(C)C(O)CCC2C2C1c1ccc(cc1CC2)O 0.971 0.934 0.058 0.631 0.953 0.963 0.046 0.825 0.103 0.998 0.969 Compound_2116 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)S(=O)(=O)C(F)(F)F 0.438 0.629 0.285 0.524 0.925 0.632 0.772 0.91 0.296 0.698 0.413 Compound_2117 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)C 0.526 0.602 0.604 0.533 0.959 0.858 0.833 0.957 0.331 0.685 0.258 Compound_2118 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccncc1F 0.476 0.607 0.327 0.506 0.879 0.579 0.871 0.879 0.316 0.796 0.386 Compound_2119 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)OCC 0.499 0.642 0.503 0.543 0.961 0.862 0.081 0.979 0.15 0.363 0.564 Compound_2120 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1C)F 0.532 0.586 0.781 0.511 0.963 0.808 0.802 0.958 0.28 0.652 0.344 Compound_2121 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)F 0.52 0.586 0.792 0.488 0.963 0.808 0.802 0.961 0.378 0.652 0.344 Compound_2122 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)n1cn[nH]c1=O 0.678 0.667 0.034 0.53 0.978 0.961 0.576 0.926 0.384 0.039 0.166 Compound_2123 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cc(c(c2)O)F 0.945 0.409 0.095 0.78 0.841 0.732 0.948 0.859 0.538 0.968 0.892 Compound_2124 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)Cl 0.518 0.602 0.792 0.488 0.956 0.822 0.042 0.961 0.277 0.784 0.592 Compound_2125 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1C 0.51 0.582 0.608 0.493 0.949 0.838 0.081 0.972 0.174 0.647 0.35 Compound_2126 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1=CCOCC1 0.72 0.653 0.589 0.498 0.892 0.799 0.089 0.928 0.227 0.666 0.386 Compound_2127 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1C(F)(F)F 0.54 0.604 0.455 0.512 0.99 0.71 0.81 0.971 0.129 0.642 0.51 Compound_2128 Oc1ccc2c(c1)OCC(C2c1ccc(cc1)OCCN1CCCCC1)c1ccccc1 0.269 0.679 0.195 0.504 0.942 0.861 0.181 0.43 0.265 0.195 0.448 Compound_2129 C#CC(c1ccc(cc1)O)Cc1ccc(cc1)O 0.68 0.784 0.5 0.544 0.888 0.916 0.996 0.772 0.287 0.598 0.748 Compound_2130 N#Cc1c(NC(=O)c2noc(c2)C)sc2c1CCC2 0.505 0.607 0.531 0.454 0.615 0.62 0.837 0.843 0.735 0.782 0.679 Compound_2131 Oc1cccc(c1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.935 0.338 0.173 0.822 0.838 0.732 0.923 0.805 0.369 0.967 0.918 Compound_2132 FCCCNCCOc1ccc(cn1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.64 0.668 0.058 0.278 0.528 0.671 0.967 0.652 0.193 0.222 0.407 Compound_2133 FCCCNCCNc1ccnc(c1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.505 0.643 0.212 0.219 0.743 0.718 0.944 0.365 0.093 0.003 0.434 Compound_2134 CCCc1nnc(o1)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.839 0.723 0.406 0.746 0.795 0.665 0.988 0.947 0.498 0.314 0.558 Compound_2135 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.589 0.681 0.914 0.42 0.842 0.664 0.974 0.549 0.606 0.688 0.5 Compound_2136 FCCCNCCOc1ccnc(c1F)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.532 0.698 0.265 0.217 0.645 0.672 0.889 0.382 0.318 0.238 0.648 Compound_2137 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.607 0.641 0.952 0.423 0.843 0.662 0.92 0.684 0.483 0.013 0.553 Compound_2138 FCCCNCCNc1ccnc(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.49 0.622 0.332 0.216 0.755 0.713 0.944 0.318 0.109 0.009 0.313 Compound_2139 FCCCNCCOc1cccc(c1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.505 0.653 0.094 0.32 0.859 0.674 0.965 0.342 0.243 0.271 0.507 Compound_2140 O=NCc1ccc(c(c1NC)c1ccccc1)c1ccccc1 0.768 0.671 0.959 0.69 0.571 0.888 0.959 0.739 0.643 0.377 0.777 Compound_2141 O=NCc1ccc(c(c1NC)c1ccccc1)c1ccc(cc1)O 0.607 0.725 0.951 0.697 0.938 0.983 0.532 0.934 0.641 0.079 0.784 Compound_2142 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC2(F)COC2)C(C)Cc2c1ccc1c2cn[nH]1 0.608 0.664 0.898 0.413 0.785 0.664 0.974 0.606 0.565 0.022 0.534 Compound_2143 COC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(F)(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.575 0.681 0.853 0.466 0.82 0.662 0.621 0.515 0.533 0.483 0.522 Compound_2144 FCC1CN(C1)CCOc1cc(F)c(c(c1)OC)C1N(CC(CO)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.642 0.621 0.955 0.449 0.858 0.661 0.92 0.751 0.531 0.017 0.51 Compound_2145 FCCCNCCNc1ncc(c(c1)F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.566 0.647 0.297 0.304 0.482 0.714 0.965 0.503 0.128 0.071 0.459 Compound_2146 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1)OC(F)F 0.494 0.592 0.125 0.546 0.988 0.696 0.81 0.975 0.261 0.62 0.373 Compound_2147 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1F)Cl 0.505 0.621 0.491 0.493 0.984 0.799 0.564 0.972 0.34 0.836 0.615 Compound_2148 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1C)C(F)(F)F 0.54 0.62 0.462 0.562 0.983 0.86 0.896 0.975 0.34 0.53 0.459 Compound_2149 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)non2 0.577 0.691 0.619 0.59 0.946 0.567 0.802 0.977 0.207 0.6 0.474 Compound_2150 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)C)Cl 0.639 0.619 0.899 0.454 0.98 0.866 0.084 0.901 0.321 0.808 0.5 Compound_2151 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)CCCN2 0.734 0.494 0.775 0.411 0.979 0.845 0.314 0.935 0.448 0.442 0.452 Compound_2152 Cc1ccc(cc1)S(=O)(=O)OCCCCCCCCCCC1CC2(C)C(O)CCC2C2C1c1ccc(cc1CC2)O 0.88 0.789 0.053 0.525 0.981 0.842 0.18 0.274 0.333 0.902 0.367 Compound_2153 CCCc1nnc([nH]1)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.751 0.64 0.552 0.737 0.686 0.667 0.923 0.897 0.639 0.7 0.651 Compound_2154 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1F)OC)F 0.514 0.644 0.634 0.475 0.963 0.808 0.802 0.897 0.38 0.155 0.318 Compound_2155 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1F)Cl)OCC 0.633 0.699 0.31 0.568 0.949 0.738 0.713 0.99 0.315 0.686 0.646 Compound_2156 FCCCN1CC(C1)Nc1cnc(c(c1)OC)C1N(CC(F)(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.599 0.549 0.967 0.253 0.712 0.651 0.948 0.657 0.482 0.129 0.533 Compound_2157 COCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)OCCN1CC(C1)CF)ccc1c2cn[nH]1)(F)C 0.608 0.721 0.925 0.411 0.842 0.664 0.974 0.553 0.53 0.424 0.621 Compound_2158 NCc1ccc(cc1)C#CC1(O)CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.791 0.813 0.008 0.388 0.965 0.986 0.427 0.048 0.136 0.027 0.66 Compound_2159 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc(n1C)C)c1ccc(cc1C)F 0.84 0.695 0.969 0.752 0.715 0.706 0.561 0.953 0.797 0.976 0.635 Compound_2160 FCC1CN(C1)CCOc1cnc(c(c1)F)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.616 0.636 0.931 0.326 0.718 0.652 0.972 0.804 0.492 0.172 0.441 Compound_2161 OCC12COC(C(C2)C(=CC1)C)c1ccc(c(c1)F)O 0.847 0.531 0.103 0.652 0.948 0.966 0.127 0.905 0.416 0.519 0.764 Compound_2162 COc1cc(cc2c1NC(C1CCC=CC1)C1C2C=CC1)N(=O)=O 0.737 0.577 0.832 0.516 0.401 0.457 0.166 0.564 0.724 0.938 0.782 Compound_2163 FCC1CN(C1)CCOc1ccc(c(n1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.693 0.661 0.944 0.319 0.794 0.661 0.989 0.733 0.493 0.081 0.375 Compound_2164 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)C(F)F 0.54 0.601 0.289 0.544 0.979 0.87 0.894 0.978 0.252 0.793 0.402 Compound_2165 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1Cl)Cl)OCC 0.633 0.699 0.31 0.568 0.903 0.812 0.097 0.99 0.227 0.686 0.646 Compound_2166 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)NCCC2 0.626 0.494 0.561 0.38 0.963 0.762 0.344 0.936 0.387 0.442 0.452 Compound_2167 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1cc(O)cc2)c1cccc(c1)O 0.514 0.62 0.455 0.512 0.959 0.87 0.062 0.971 0.09 0.693 0.601 Compound_2168 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)OC(F)F 0.499 0.592 0.283 0.544 0.982 0.836 0.872 0.974 0.195 0.634 0.41 Compound_2169 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)C(F)(F)F 0.55 0.62 0.705 0.545 0.986 0.871 0.896 0.976 0.283 0.483 0.494 Compound_2170 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(cc1F)OC 0.528 0.644 0.543 0.534 0.963 0.808 0.802 0.93 0.354 0.155 0.318 Compound_2171 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1C)Cl 0.574 0.602 0.781 0.511 0.97 0.803 0.046 0.958 0.187 0.784 0.592 Compound_2172 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)Cc1ccc(cc1)O 0.764 0.448 0.682 0.693 0.845 0.742 0.935 0.84 0.528 0.978 0.888 Compound_2173 CCc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.917 0.442 0.15 0.827 0.83 0.75 0.936 0.806 0.478 0.15 0.65 Compound_2174 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cc([nH]2)C 0.634 0.542 0.651 0.458 0.959 0.724 0.983 0.982 0.202 0.852 0.696 Compound_2175 CCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCN(C)C)c1ccccc1 0.711 0.561 0.078 0.561 0.929 0.995 0.025 0.557 0.482 0.113 0.401 Compound_2176 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)C(F)(F)C 0.569 0.634 0.279 0.533 0.98 0.869 0.895 0.979 0.229 0.498 0.397 Compound_2177 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)F)OC 0.554 0.715 0.747 0.489 0.777 0.575 0.778 0.915 0.438 0.229 0.3 Compound_2178 CCCc1c2cccc3n2c(c1c1ccc(cc1)O)cc3 0.444 0.655 0.077 0.711 0.916 0.758 0.835 0.961 0.836 0.633 0.761 Compound_2179 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)C1CCCC1 0.716 0.503 0.446 0.643 0.825 0.768 0.316 0.794 0.465 0.374 0.715 Compound_2180 CCC(=O)Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=CC(=O)O)c1ccccc1C(C)C 0.719 0.673 0.242 0.7 0.919 0.721 0.992 0.701 0.254 0.953 0.82 Compound_2181 CC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C(F)(F)F)F 0.92 0.645 0.956 0.768 0.931 0.728 0.956 0.988 0.79 0.967 0.755 Compound_2182 FCCCNCCOc1ccnc(c1F)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.537 0.653 0.282 0.255 0.638 0.664 0.937 0.471 0.3 0.242 0.522 Compound_2183 N#CC(C(c1ccc(cc1)O)C)c1ccc(cc1)O 0.574 0.741 0.294 0.586 0.954 0.8 0.977 0.72 0.376 0.36 0.912 Compound_2184 COCC(CN1C(C)Cc2c(C1c1ccc(cc1OC)OCCN1CC(C1)CF)ccc1c2cn[nH]1)(F)F 0.613 0.671 0.969 0.394 0.852 0.663 0.974 0.642 0.538 0.367 0.606 Compound_2185 FCCCNCCOc1cc(F)cc(c1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.491 0.562 0.293 0.264 0.923 0.674 0.915 0.339 0.333 0.255 0.548 Compound_2186 FCCCN(CCOc1ccc(c(c1F)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C 0.477 0.747 0.302 0.468 0.899 0.679 0.981 0.638 0.366 0.468 0.71 Compound_2187 O=C(C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C)OCCN1CCOCC1 0.654 0.525 0.649 0.572 0.885 0.695 0.948 0.942 0.351 0.849 0.509 Compound_2188 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.569 0.592 0.914 0.39 0.827 0.665 0.742 0.665 0.574 0.488 0.481 Compound_2189 FCC1CN(C1)CCOc1ccc(nc1)C1N(CC(F)F)C(C)Cc2c1ccc1c2cn[nH]1 0.635 0.636 0.927 0.31 0.668 0.651 0.972 0.913 0.381 0.181 0.484 Compound_2190 Oc1ccc2c(c1)CCC1C2C(CCOS(=O)(=O)C)CC2(C1CCC2O)C 0.96 0.804 0.042 0.489 0.9 0.986 0.03 0.201 0.254 0.954 0.37 Compound_2191 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1OC)OC 0.462 0.678 0.541 0.486 0.969 0.847 0.269 0.949 0.369 0.396 0.397 Compound_2192 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)N1CCOCC1 0.71 0.677 0.374 0.52 0.99 0.901 0.403 0.976 0.352 0.731 0.571 Compound_2193 Oc1ccc2c(c1)CCC1C2C(CCCCOS(=O)(=O)C)CC2(C1CCC2O)C 0.958 0.804 0.034 0.494 0.897 0.991 0.071 0.232 0.256 0.954 0.37 Compound_2194 FCCCNCCNc1cnc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.597 0.603 0.563 0.264 0.658 0.7 0.901 0.469 0.282 0.045 0.594 Compound_2195 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)onc2 0.551 0.629 0.559 0.536 0.909 0.814 0.971 0.972 0.289 0.656 0.551 Compound_2196 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1C)OC 0.445 0.671 0.061 0.379 0.91 0.926 0.812 0.881 0.511 0.578 0.488 Compound_2197 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1conc1 0.532 0.629 0.327 0.493 0.844 0.662 0.285 0.88 0.289 0.656 0.551 Compound_2198 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1C(F)(F)F)F 0.516 0.604 0.555 0.501 0.988 0.696 0.81 0.971 0.251 0.684 0.472 Compound_2199 CC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.851 0.722 0.868 0.825 0.918 0.762 0.983 0.986 0.791 0.981 0.729 Compound_2200 FCCCNCCOc1cc(C)cc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.505 0.582 0.12 0.301 0.917 0.678 0.915 0.445 0.377 0.119 0.648 Compound_2201 FCCCNCCOc1ccc(c(c1F)C1N(CC2(CC2)S(=O)(=O)C)C(C)Cc2c1[nH]c1c2cccc1)F 0.486 0.703 0.418 0.361 0.789 0.687 0.978 0.335 0.41 0.297 0.338 Compound_2202 Oc1ccc2c(c1)OCC(C2c1ccc(cc1)SCCN1CCCC1)c1ccccc1 0.381 0.507 0.195 0.514 0.955 0.847 0.085 0.331 0.251 0.403 0.493 Compound_2203 FCC1CN(C1)CCOc1ncc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.684 0.666 0.776 0.329 0.76 0.66 0.99 0.458 0.46 0.092 0.384 Compound_2204 N#CC(c1ccc(cc1)O)Cc1ccc(cc1C)O 0.721 0.646 0.63 0.549 0.951 0.575 0.968 0.789 0.375 0.423 0.917 Compound_2205 C=Cc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.918 0.471 0.112 0.874 0.842 0.758 0.959 0.92 0.468 0.482 0.547 Compound_2206 OCCC(=C(c1ccccc1)c1ccc(cc1)OCCN(C)C)c1ccccc1 0.271 0.311 0.005 0.778 0.89 0.971 0.002 0.125 0.076 0.007 0.029 Compound_2207 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)CCN2 0.755 0.514 0.655 0.411 0.983 0.884 0.257 0.932 0.332 0.405 0.57 Compound_2208 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc2c(c1)cc[nH]2 0.613 0.488 0.568 0.456 0.65 0.704 0.842 0.955 0.429 0.893 0.459 Compound_2209 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1CC 0.505 0.609 0.569 0.499 0.961 0.862 0.081 0.967 0.201 0.797 0.423 Compound_2210 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)OC(=O)C(C(C)C)N)c1ccccc1C(C)C 0.58 0.679 0.331 0.609 0.877 0.688 0.997 0.707 0.288 0.702 0.793 Compound_2211 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)n(C)nn2 0.526 0.713 0.256 0.555 0.886 0.701 0.857 0.938 0.201 0.26 0.363 Compound_2212 FCC1CN(C1)CCOc1ccc(nc1)C1c2ccc3c(c2CC(N1CC(F)F)(C)C)cn[nH]3 0.625 0.688 0.889 0.293 0.655 0.653 0.972 0.913 0.398 0.063 0.5 Compound_2213 CCC(=C(c1ccc(cc1)I)c1ccc(cc1)OCCN1CCCC1)c1ccccc1 0.218 0.572 0.248 0.539 0.853 0.876 0.008 0.722 0.346 0.977 0.5 Compound_2214 COCC(CN1C(C)Cc2c(C1c1ccc(cn1)OCCN1CC(C1)CF)ccc1c2cn[nH]1)(F)F 0.655 0.641 0.977 0.299 0.679 0.653 0.98 0.854 0.388 0.032 0.577 Compound_2215 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc2c1cccn2 0.612 0.623 0.779 0.503 0.937 0.739 0.899 0.819 0.288 0.853 0.522 Compound_2216 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1C)OCC 0.654 0.674 0.44 0.535 0.912 0.883 0.049 0.982 0.133 0.218 0.588 Compound_2217 N#Cc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.939 0.445 0.183 0.885 0.889 0.687 0.974 0.842 0.501 0.364 0.913 Compound_2218 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)OP(=O)(O)O)c1ccc(cc1)OC(F)(F)F 0.453 0.648 0.043 0.453 0.963 0.381 0.914 0.779 0.17 0.895 0.464 Compound_2219 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)[nH]cc2 0.562 0.534 0.347 0.533 0.895 0.699 0.889 0.974 0.207 0.905 0.769 Compound_2220 Oc1ccc(cc1)c1c2ccc3n2c(c1C(C)C)ccc3 0.516 0.684 0.346 0.751 0.917 0.763 0.87 0.955 0.74 0.692 0.71 Compound_2221 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(c(c1)F)OC 0.511 0.644 0.425 0.527 0.963 0.808 0.802 0.943 0.366 0.155 0.318 Compound_2222 CCC12CCC(=O)C(=C2c2c(C1)c1c(F)[nH]nc1cc2)C(F)(F)F 0.822 0.816 0.748 0.634 0.893 0.707 0.914 0.979 0.502 0.62 0.8 Compound_2223 O=NCc1c(O)ccc(c1Cl)c1ccc(c(c1)F)O 0.841 0.587 0.721 0.713 0.882 0.85 0.083 0.989 0.76 0.229 0.778 Compound_2224 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)OC(F)(F)F 0.505 0.65 0.512 0.507 0.99 0.808 0.874 0.94 0.185 0.306 0.49 Compound_2225 CCOC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.855 0.679 0.896 0.843 0.929 0.749 0.996 0.95 0.504 0.944 0.797 Compound_2226 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(c(c1)F)OC(F)F 0.505 0.592 0.244 0.56 0.988 0.696 0.81 0.977 0.278 0.62 0.373 Compound_2227 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1)OC(F)F 0.581 0.604 0.424 0.505 0.885 0.507 0.902 0.926 0.106 0.718 0.406 Compound_2228 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1C)OC 0.651 0.674 0.672 0.505 0.924 0.879 0.049 0.969 0.241 0.083 0.437 Compound_2229 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)S(=O)(=O)C 0.449 0.659 0.502 0.519 0.857 0.702 0.692 0.913 0.367 0.711 0.388 Compound_2230 FCCCNCCOc1ccc(c(c1)C#N)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.575 0.647 0.286 0.286 0.882 0.674 0.925 0.374 0.405 0.18 0.813 Compound_2231 Oc1ccc2c(c1)C(=CC12CCc2c1ccc(c2)O)c1ccc(cc1)OCCN1CCCCC1 0.454 0.747 0.456 0.68 0.969 0.825 0.031 0.819 0.279 0.423 0.522 Compound_2232 FCCCNCCOc1cncc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.534 0.562 0.264 0.278 0.624 0.622 0.912 0.429 0.347 0.194 0.707 Compound_2233 FCC1CN(C1)CCOc1ccc(cc1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.559 0.696 0.616 0.391 0.827 0.662 0.978 0.686 0.412 0.106 0.524 Compound_2234 FCCCNCCNc1cc(c(cc1F)OC)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.577 0.497 0.599 0.239 0.922 0.716 0.955 0.287 0.211 0.069 0.726 Compound_2235 FCCCNCCOc1cc(F)cc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.468 0.562 0.267 0.294 0.923 0.674 0.915 0.423 0.385 0.255 0.548 Compound_2236 FCC1CN(C1)CCOc1ccc(nc1)C1N(CC(C)C)C(C)Cc2c1ccc1c2cn[nH]1 0.622 0.639 0.92 0.316 0.629 0.654 0.652 0.891 0.377 0.406 0.458 Compound_2237 CCc1c2cccc3n2c(c1c1ccc(cc1)O)cc3 0.527 0.737 0.263 0.747 0.907 0.742 0.835 0.981 0.836 0.673 0.865 Compound_2238 Oc1ccc2c(c1)OCC(C2c1ccc(cc1)SCCN1CCCCC1)c1ccccc1 0.414 0.486 0.195 0.504 0.942 0.841 0.133 0.43 0.267 0.202 0.466 Compound_2239 O=C(C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)F)NCCC(F)(F)F 0.647 0.489 0.282 0.685 0.898 0.716 0.984 0.944 0.676 0.102 0.438 Compound_2240 FCC1CN(C1)CCOc1ccc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.602 0.666 0.802 0.417 0.847 0.661 0.974 0.578 0.604 0.055 0.505 Compound_2241 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1O 0.938 0.338 0.173 0.771 0.814 0.738 0.944 0.878 0.469 0.967 0.918 Compound_2242 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)CCCN1CCCCC1)c1ccc(cc1)O 0.793 0.493 0.097 0.731 0.822 0.772 0.708 0.889 0.611 0.128 0.533 Compound_2243 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccsc1 0.918 0.415 0.284 0.731 0.83 0.774 0.882 0.906 0.481 0.364 0.674 Compound_2244 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)N(CCN1CCCCC1)C)c1ccc(cc1)O 0.772 0.612 0.632 0.706 0.911 0.777 0.955 0.859 0.598 0.031 0.552 Compound_2245 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)OC)F 0.505 0.644 0.562 0.499 0.963 0.808 0.802 0.951 0.379 0.155 0.318 Compound_2246 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C(F)(F)F)F 0.547 0.604 0.672 0.499 0.988 0.696 0.81 0.968 0.225 0.684 0.472 Compound_2247 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1C)C(C)(C)C 0.536 0.756 0.406 0.492 0.963 0.959 0.169 0.973 0.613 0.845 0.513 Compound_2248 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cccc(c1OC)F 0.481 0.644 0.817 0.448 0.943 0.806 0.789 0.919 0.275 0.155 0.318 Compound_2249 O=NCc1cc(ccc1O)c1ccc(cc1)O 0.594 0.633 0.855 0.735 0.463 0.985 0.349 0.985 0.815 0.061 0.575 Compound_2250 CCCn1cncc1C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.751 0.661 0.516 0.754 0.804 0.717 0.763 0.961 0.911 0.264 0.668 Compound_2251 CCCn1cnc(c1)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.748 0.68 0.546 0.769 0.804 0.717 0.763 0.968 0.911 0.191 0.648 Compound_2252 C=CCCC1CC2(C)C(O)CCC2C2C1c1ccc(cc1CC2)O 0.969 0.963 0.088 0.626 0.991 0.99 0.02 0.971 0.018 0.998 0.82 Compound_2253 CCC(c1ccc(cc1)O)(Cc1ccc(cc1)O)C 0.527 0.793 0.302 0.594 0.967 0.99 0.969 0.345 0.433 0.812 0.936 Compound_2254 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1Cl)OC(F)(F)F 0.558 0.64 0.386 0.524 0.99 0.685 0.577 0.928 0.194 0.765 0.698 Compound_2255 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1Cl)C(F)(F)F 0.663 0.64 0.472 0.514 0.994 0.787 0.896 0.978 0.175 0.927 0.766 Compound_2256 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnnn1C)c1ccc(cc1C)F 0.903 0.726 0.945 0.746 0.736 0.707 0.309 0.977 0.784 0.977 0.619 Compound_2257 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)OC(C(O2)(F)F)(F)F 0.539 0.614 0.506 0.516 0.978 0.486 0.925 0.966 0.315 0.903 0.415 Compound_2258 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)OC(=O)C)c1ccccc1C(C)C 0.759 0.692 0.555 0.68 0.921 0.723 0.992 0.669 0.677 0.94 0.745 Compound_2259 Oc1ccc(cc1)C=C(c1ccc(cc1)O)C 0.903 0.807 0.126 0.507 0.835 0.957 0.759 0.422 0.875 0.946 0.968 Compound_2260 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cncc(c1)Cl 0.512 0.613 0.554 0.498 0.876 0.538 0.086 0.905 0.341 0.896 0.604 Compound_2261 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1)C(F)(F)F 0.579 0.624 0.322 0.48 0.963 0.629 0.95 0.925 0.074 0.72 0.638 Compound_2262 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)F)OC(F)F 0.515 0.592 0.425 0.55 0.988 0.696 0.81 0.972 0.259 0.62 0.373 Compound_2263 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)OC(F)(F)F 0.551 0.624 0.386 0.524 0.988 0.696 0.81 0.928 0.221 0.472 0.472 Compound_2264 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)F)C 0.505 0.602 0.509 0.474 0.959 0.858 0.833 0.907 0.407 0.685 0.258 Compound_2265 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1CCC2(CC1)OCCO2 0.683 0.677 0.418 0.459 0.959 0.859 0.253 0.929 0.306 0.848 0.48 Compound_2266 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)Cl)OCC 0.592 0.699 0.461 0.589 0.944 0.749 0.046 0.981 0.24 0.686 0.646 Compound_2267 FCCCNCCOc1cnc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.551 0.592 0.264 0.25 0.624 0.622 0.912 0.518 0.406 0.103 0.674 Compound_2268 FCCCNCCOc1ccc(nc1)C1N(CC2(F)CC2)C(C)Cc2c1[nH]c1c2cccc1 0.599 0.667 0.202 0.22 0.5 0.635 0.949 0.593 0.311 0.158 0.664 Compound_2269 CCc1c2c(CO)ccc3n2c(c1c1ccc(cc1)O)cc3 0.274 0.682 0.121 0.694 0.893 0.734 0.715 0.895 0.604 0.19 0.943 Compound_2270 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1)C(F)(F)F 0.525 0.604 0.232 0.551 0.987 0.754 0.841 0.975 0.265 0.684 0.472 Compound_2271 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cncc(c1)F 0.474 0.607 0.554 0.498 0.848 0.537 0.871 0.905 0.224 0.796 0.386 Compound_2272 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)Cl)OCC 0.574 0.775 0.534 0.536 0.651 0.541 0.121 0.954 0.544 0.613 0.627 Compound_2273 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)F)Cl 0.543 0.621 0.825 0.497 0.984 0.799 0.564 0.977 0.38 0.836 0.615 Compound_2274 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)Cl)C 0.549 0.619 0.509 0.474 0.967 0.846 0.093 0.907 0.389 0.808 0.5 Compound_2275 FCCCNCCOc1ccc(c(n1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)OC 0.661 0.643 0.232 0.231 0.786 0.639 0.931 0.602 0.366 0.045 0.514 Compound_2276 N#CC(C(c1ccc(cc1)O)C#N)c1ccc(cc1)O 0.621 0.778 0.457 0.618 0.957 0.828 0.988 0.7 0.391 0.373 0.974 Compound_2277 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1Cl)OC(F)(F)F 0.556 0.64 0.216 0.522 0.988 0.679 0.577 0.935 0.277 0.765 0.698 Compound_2278 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)C)OC 0.632 0.711 0.79 0.517 0.666 0.6 0.046 0.922 0.438 0.104 0.339 Compound_2279 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)C)OCC 0.625 0.674 0.424 0.544 0.654 0.64 0.046 0.96 0.335 0.218 0.588 Compound_2280 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1C)C)OCC 0.622 0.662 0.459 0.553 0.926 0.894 0.139 0.98 0.171 0.706 0.649 Compound_2281 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)OC)c1ccccc1C(C)C 0.83 0.715 0.873 0.857 0.893 0.727 0.999 0.894 0.725 0.982 0.741 Compound_2282 Oc1ccc(cc1)C(=C(c1ccc(cc1)O)C)c1ccc(cc1)O 0.945 0.795 0.527 0.588 0.993 0.997 0.261 0.94 0.86 0.892 0.959 Compound_2283 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1F)OC(F)(F)F 0.505 0.624 0.216 0.522 0.988 0.696 0.81 0.935 0.242 0.472 0.472 Compound_2284 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccccc1C(C)C 0.505 0.607 0.476 0.481 0.963 0.871 0.081 0.973 0.138 0.552 0.239 Compound_2285 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)C1COC1 0.541 0.573 0.232 0.516 0.958 0.813 0.153 0.974 0.295 0.654 0.525 Compound_2286 COCCC(=O)Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=CC(=O)O)c1ccccc1C(C)C 0.684 0.753 0.189 0.659 0.917 0.713 0.996 0.706 0.372 0.648 0.871 Compound_2287 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)CCN2CC 0.756 0.624 0.143 0.543 0.989 0.908 0.597 0.986 0.406 0.806 0.77 Compound_2288 COc1ccccc1N1CCN(CC1)C(=O)c1ccc2c(c1)nc(c(n2)c1ccco1)c1ccco1 0.376 0.747 0.366 0.449 0.592 0.625 0.98 0.066 0.414 0.248 0.494 Compound_2289 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(cc1Cl)Cl 0.584 0.621 0.495 0.525 0.992 0.802 0.564 0.978 0.341 0.836 0.615 Compound_2290 N#CC(c1ccc(cc1C)O)Cc1ccc(cc1)O 0.731 0.628 0.494 0.627 0.951 0.575 0.968 0.844 0.469 0.348 0.93 Compound_2291 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1OC)F 0.479 0.644 0.689 0.445 0.943 0.806 0.789 0.931 0.383 0.155 0.318 Compound_2292 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc(o1)C1CC1)c1ccc(cc1C)F 0.875 0.675 0.722 0.745 0.791 0.66 0.989 0.971 0.524 0.576 0.658 Compound_2293 Oc1ccc(cc1)CC(c1ccc(cc1)O)(C)C 0.569 0.673 0.335 0.559 0.967 0.99 0.969 0.283 0.522 0.726 0.686 Compound_2294 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1Cl)Cl 0.607 0.653 0.234 0.51 0.972 0.811 0.081 0.969 0.24 0.929 0.689 Compound_2295 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)C(F)(F)F 0.538 0.604 0.457 0.544 0.989 0.769 0.841 0.974 0.199 0.642 0.51 Compound_2296 FCCCNCCOc1ncnc(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.601 0.628 0.4 0.268 0.744 0.686 0.903 0.495 0.268 0.302 0.375 Compound_2297 Oc1ccc(cc1)CC(c1ccc(cc1)O)C(=O)C 0.388 0.778 0.513 0.612 0.906 0.962 0.977 0.292 0.268 0.518 0.59 Compound_2298 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)Cl)OC 0.581 0.725 0.747 0.489 0.697 0.544 0.121 0.915 0.634 0.472 0.5 Compound_2299 OCC12COC(C(C2)C(=CC1)C)c1ccc(cc1Cl)O 0.811 0.581 0.096 0.622 0.987 0.892 0.036 0.873 0.436 0.618 0.891 Compound_2300 Oc1ccc2c(c1)OCC(C2c1ccc(cc1)OCCN1CCCC1)c1ccccc1 0.252 0.662 0.195 0.514 0.961 0.854 0.116 0.331 0.264 0.393 0.515 Compound_2301 O=NCc1ccc(c(c1O)Cl)c1ccc(c(c1)F)O 0.824 0.587 0.573 0.711 0.879 0.765 0.346 0.985 0.614 0.229 0.778 Compound_2302 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(=O)N(C)C 0.915 0.613 0.189 0.833 0.788 0.769 0.979 0.911 0.449 0.255 0.559 Compound_2303 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)OCCN2C 0.684 0.737 0.358 0.484 0.963 0.672 0.449 0.958 0.392 0.287 0.481 Compound_2304 C#Cc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.887 0.415 0.189 0.851 0.738 0.749 0.963 0.816 0.494 0.364 0.562 Compound_2305 CCc1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.754 0.542 0.262 0.547 0.773 0.741 0.171 0.816 0.505 0.266 0.608 Compound_2306 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cncc(c1)C 0.565 0.6 0.633 0.506 0.725 0.645 0.103 0.906 0.221 0.579 0.334 Compound_2307 O=NCc1ccc(c2c1scc2)c1ccc(cc1)O 0.655 0.636 0.873 0.611 0.639 0.793 0.295 0.961 0.703 0.737 0.493 Compound_2308 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(cc1F)OCC 0.522 0.682 0.579 0.594 0.971 0.834 0.802 0.975 0.234 0.53 0.43 Compound_2309 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1cccs1 0.926 0.415 0.335 0.623 0.83 0.774 0.882 0.834 0.511 0.364 0.674 Compound_2310 CCCC(c1ccc(cc1)O)(Cc1ccc(cc1)O)C 0.668 0.72 0.292 0.601 0.967 0.99 0.969 0.47 0.534 0.95 0.966 Compound_2311 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1)OC(F)(F)F 0.494 0.624 0.146 0.533 0.988 0.696 0.81 0.96 0.227 0.472 0.472 Compound_2312 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)C(=O)O)c1ccc(cc1F)Cl 0.411 0.628 0.245 0.369 0.97 0.876 0.951 0.857 0.523 0.612 0.534 Compound_2313 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1F)C(F)(F)F 0.625 0.634 0.472 0.514 0.992 0.77 0.95 0.978 0.166 0.758 0.582 Compound_2314 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.864 0.744 0.781 0.834 0.925 0.745 0.997 0.977 0.671 0.944 0.679 Compound_2315 N#CC(c1ccc(cc1)O)(Cc1ccc(cc1)O)C 0.51 0.789 0.596 0.634 0.969 0.9 0.925 0.701 0.527 0.043 0.898 Compound_2316 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1)SC(F)(F)F 0.467 0.596 0.146 0.533 0.967 0.678 0.783 0.96 0.242 0.761 0.638 Compound_2317 COc1ccc(c(n1)C(F)(F)F)c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.803 0.615 0.858 0.626 0.896 0.739 0.996 0.97 0.732 0.303 0.9 Compound_2318 CCCCC12CCC(=O)C(=C2c2c(C1)c1c(F)[nH]nc1cc2)CC 0.81 0.87 0.756 0.522 0.834 0.719 0.853 0.968 0.571 0.928 0.751 Compound_2319 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1)O 0.511 0.569 0.067 0.496 0.934 0.945 0.904 0.976 0.567 0.94 0.528 Compound_2320 FCCCNCCOc1cccc(c1OC)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.569 0.633 0.13 0.269 0.77 0.665 0.968 0.246 0.292 0.042 0.531 Compound_2321 Oc1ccc(cc1)C1=c2ccc3=CC=C4C(C1CCCC4)n23 0.645 0.584 0.394 0.558 0.684 0.945 0.247 0.902 0.659 0.989 0.679 Compound_2322 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(nc1)N 0.484 0.476 0.369 0.416 0.793 0.425 0.134 0.885 0.263 0.526 0.737 Compound_2323 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)n(C)cn2 0.528 0.675 0.215 0.624 0.832 0.747 0.913 0.948 0.166 0.419 0.467 Compound_2324 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(c(c1)F)OC(F)F 0.515 0.592 0.425 0.547 0.988 0.696 0.81 0.972 0.334 0.62 0.373 Compound_2325 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1F)OCC(F)F 0.615 0.655 0.383 0.573 0.99 0.82 0.872 0.97 0.345 0.725 0.407 Compound_2326 Oc1ccc(cc1)c1c2ccc3n2c(c1C)ccc3 0.745 0.758 0.271 0.761 0.907 0.742 0.835 0.946 0.894 0.861 0.781 Compound_2327 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1CN1CCCC1 0.637 0.534 0.383 0.588 0.852 0.714 0.795 0.884 0.537 0.96 0.71 Compound_2328 FCC1CN(C1)CCOc1ccc(cc1)C1C(CCc2c1c(O)ccc2)c1ccccc1 0.409 0.478 0.281 0.521 0.938 0.683 0.188 0.771 0.203 0.811 0.5 Compound_2329 COC(=O)c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.869 0.446 0.155 0.826 0.777 0.745 0.969 0.511 0.523 0.466 0.682 Compound_2330 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1)Cl 0.51 0.653 0.235 0.489 0.877 0.62 0.081 0.911 0.069 0.929 0.689 Compound_2331 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)S(=O)(=O)CCN1CCCCC1)c1ccc(cc1)O 0.646 0.471 0.206 0.714 0.724 0.716 0.437 0.885 0.355 0.163 0.235 Compound_2332 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(C)C 0.917 0.511 0.132 0.871 0.831 0.77 0.969 0.872 0.445 0.099 0.48 Compound_2333 Oc1ccc(cc1)C1=c2ccc3=CC=C4C(C1CCC4)n23 0.645 0.683 0.394 0.558 0.938 0.97 0.335 0.902 0.675 0.961 0.823 Compound_2334 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)C(C)(C)C 0.519 0.681 0.267 0.512 0.97 0.95 0.196 0.979 0.537 0.864 0.427 Compound_2335 FCCCNCCOc1cc(ccc1F)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.467 0.562 0.602 0.303 0.923 0.674 0.915 0.367 0.363 0.255 0.548 Compound_2336 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(=O)C 0.942 0.402 0.171 0.874 0.828 0.744 0.937 0.863 0.403 0.796 0.789 Compound_2337 Oc1ccc(cc1)n1cc(Br)c2c(c1=O)c(O)cc(c2)O 0.704 0.718 0.503 0.57 0.852 0.909 0.968 0.607 0.908 0.542 0.754 Compound_2338 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc(o1)C1CC1)c1ccccc1C(C)C 0.839 0.762 0.467 0.768 0.795 0.662 0.988 0.954 0.495 0.685 0.547 Compound_2339 Oc1ccc2c(c1)CCC1C2CCC2(C1CC=C2C)C 0.972 0.819 0.067 0.593 0.981 0.958 0.162 0.941 0.294 0.996 0.994 Compound_2340 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)ccn2C 0.61 0.681 0.883 0.563 0.964 0.858 0.977 0.929 0.201 0.573 0.631 Compound_2341 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1CCC(CC1)(F)F 0.601 0.64 0.759 0.447 0.965 0.802 0.932 0.91 0.259 0.664 0.469 Compound_2342 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)ncs2 0.692 0.583 0.777 0.585 0.684 0.791 0.857 0.964 0.319 0.912 0.588 Compound_2343 O=C(N1CCN(CC1)C(=O)c1ccco1)COC(=O)c1cc(nc2c1cccc2)c1ccco1 0.236 0.764 0.807 0.575 0.47 0.556 0.997 0.105 0.402 0.84 0.591 Compound_2344 FCCCNCCNc1cccc(c1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.49 0.652 0.187 0.256 0.768 0.696 0.977 0.335 0.118 0.016 0.507 Compound_2345 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)c1cccs1 0.733 0.846 0.1 0.415 0.743 0.681 0.98 0.284 0.787 0.73 0.748 Compound_2346 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(C)c(cc1C)OC 0.61 0.644 0.657 0.514 0.924 0.929 0.158 0.958 0.493 0.38 0.539 Compound_2347 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(c(c1)C)Cl 0.621 0.619 0.843 0.471 0.984 0.846 0.706 0.915 0.376 0.808 0.5 Compound_2348 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)C 0.781 0.542 0.601 0.643 0.773 0.741 0.171 0.819 0.511 0.305 0.473 Compound_2349 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cccc2 0.92 0.415 0.183 0.822 0.838 0.79 0.954 0.705 0.497 0.364 0.674 Compound_2350 O=NCc1ccc(c2c1ccs2)c1ccc(cc1)O 0.605 0.636 0.85 0.654 0.639 0.793 0.295 0.901 0.703 0.737 0.493 Compound_2351 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccn(=O)cc1 0.499 0.615 0.277 0.526 0.861 0.663 0.145 0.976 0.341 0.365 0.593 Compound_2352 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1cc(O)cc2)c1ccc2c(c1)cc[nH]2 0.558 0.554 0.619 0.503 0.908 0.7 0.929 0.975 0.215 0.904 0.826 Compound_2353 FCCCNCCOc1ccc(nc1)C1N(CC2(F)COC2)C(C)Cc2c1[nH]c1c2cccc1 0.602 0.653 0.188 0.243 0.512 0.635 0.964 0.635 0.309 0.242 0.522 Compound_2354 CCC1=NC(C(N1)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.29 0.444 0.113 0.467 0.105 0.332 0.006 0.288 0.228 0.075 0.184 Compound_2355 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(c(c1)F)OCC 0.505 0.682 0.461 0.586 0.971 0.834 0.802 0.981 0.288 0.53 0.43 Compound_2356 FCCCNCCOc1ccc(c(n1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)C 0.628 0.648 0.076 0.265 0.842 0.693 0.915 0.728 0.266 0.087 0.44 Compound_2357 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)Cl)Cl 0.56 0.621 0.825 0.497 0.918 0.774 0.032 0.977 0.405 0.836 0.615 Compound_2358 CNC(=O)c1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.883 0.487 0.104 0.856 0.783 0.732 0.948 0.788 0.461 0.498 0.795 Compound_2359 CC(COC(=O)c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O)C 0.829 0.522 0.093 0.828 0.798 0.785 0.981 0.88 0.447 0.66 0.565 Compound_2360 CCCCOC(=O)c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.838 0.493 0.166 0.848 0.795 0.782 0.973 0.822 0.548 0.723 0.745 Compound_2361 Oc1ccc(cc1)n1cc(Cl)c2c(c1=O)c(O)cc(c2)O 0.689 0.731 0.503 0.57 0.973 0.979 0.972 0.607 0.891 0.498 0.81 Compound_2362 N#CC(c1ccc(cc1)O)(Cc1ccc(cc1)O)C#N 0.614 0.821 0.632 0.686 0.971 0.913 0.961 0.76 0.53 0.034 0.967 Compound_2363 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1cc(F)c(c2F)O)c1ccc(cc1)O 0.92 0.612 0.823 0.759 0.951 0.759 0.992 0.975 0.673 0.915 0.736 Compound_2364 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnc([nH]1)C)c1ccc(cc1C)F 0.829 0.706 0.981 0.727 0.703 0.666 0.917 0.91 0.83 0.546 0.719 Compound_2365 Oc1ccc(cc1)CC(C(C(F)(F)F)(F)F)c1ccc(cc1)O 0.748 0.665 0.742 0.646 0.992 0.925 0.997 0.614 0.107 0.817 0.955 Compound_2366 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(nc1)OCC 0.537 0.723 0.417 0.525 0.717 0.466 0.29 0.918 0.196 0.206 0.545 Compound_2367 COc1cc(O)c2c(c1)oc(c2C=O)c1ccc(cc1O)O 0.36 0.756 0.774 0.816 0.603 0.833 0.986 0.973 0.856 0.277 0.788 Compound_2368 Oc1ccc2c(c1)oc(c(c2=O)c1ccccc1C)C(F)(F)F 0.692 0.681 0.946 0.754 0.985 0.979 0.997 0.988 0.48 0.187 0.952 Compound_2369 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1F)C 0.435 0.63 0.084 0.409 0.936 0.92 0.972 0.903 0.511 0.566 0.197 Compound_2370 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)OCN1C(=O)c2c(S1(=O)=O)cccc2)c1ccccc1C(C)C 0.59 0.666 0.485 0.66 0.765 0.713 0.99 0.891 0.298 0.491 0.345 Compound_2371 Cc1cc(C)c2c(c1)C1C=CCC1C(N2)c1ccc(cc1)S(=O)(=O)N1CCOCC1 0.58 0.591 0.398 0.522 0.554 0.406 0.278 0.387 0.381 0.051 0.29 Compound_2372 O=C(NC(=O)NCc1ccco1)CSc1nnc(n1Cc1ccccc1)C 0.319 0.513 0.515 0.331 0.234 0.693 0.164 0.055 0.385 0.015 0.447 Compound_2373 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(cc1F)OC(F)(F)F 0.445 0.581 0.062 0.392 0.977 0.837 0.993 0.879 0.455 0.881 0.486 Compound_2374 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(c(c1)F)OC(F)(F)F 0.513 0.624 0.469 0.53 0.988 0.696 0.81 0.955 0.31 0.472 0.472 Compound_2375 COc1cc2oc(cc2cc1O)c1ccc(cc1O)O 0.505 0.721 0.918 0.72 0.673 0.578 0.586 0.992 0.629 0.755 0.794 Compound_2376 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)scn2 0.659 0.583 0.842 0.555 0.707 0.823 0.942 0.949 0.539 0.912 0.588 Compound_2377 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1conc1C 0.621 0.663 0.355 0.465 0.901 0.773 0.396 0.86 0.284 0.574 0.647 Compound_2378 CCCCC12CCC(=O)C(=C2c2c(C1)c1c(F)[nH]nc1cc2)C(F)(F)F 0.84 0.764 0.748 0.638 0.9 0.712 0.908 0.981 0.511 0.937 0.732 Compound_2379 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)O)c1ccc(cc1)C(C)(C)C 0.505 0.69 0.116 0.521 0.977 0.931 0.833 0.98 0.495 0.876 0.396 Compound_2380 COC(=O)c1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.911 0.446 0.163 0.826 0.838 0.72 0.969 0.521 0.495 0.466 0.682 Compound_2381 CCOC(=O)c1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.887 0.402 0.384 0.841 0.838 0.72 0.969 0.804 0.412 0.725 0.739 Compound_2382 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C 0.916 0.442 0.251 0.859 0.83 0.75 0.936 0.853 0.448 0.177 0.533 Compound_2383 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(nc1)OC 0.538 0.713 0.427 0.496 0.769 0.472 0.29 0.854 0.275 0.091 0.394 Compound_2384 FCCCN(CCN(c1ccc(c(c1C)C1N(CC(C(=O)O)C)C(C)Cc2c1[nH]c1c2cccc1)F)C)C 0.492 0.7 0.543 0.334 0.841 0.694 0.991 0.776 0.272 0.398 0.286 Compound_2385 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)c(c(c1)Cl)OCC 0.594 0.699 0.461 0.586 0.949 0.733 0.713 0.981 0.298 0.686 0.646 Compound_2386 FCCCNCCOc1cccc(c1)C1(C)N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.49 0.708 0.247 0.304 0.905 0.684 0.915 0.272 0.228 0.051 0.783 Compound_2387 COC(=O)C1C(=N)Oc2c(C1c1ccc(cc1)OCc1ccccc1F)ccc(c2)O 0.553 0.588 0.354 0.709 0.992 0.881 0.972 0.374 0.49 0.529 0.648 Compound_2388 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)N(C)C(=O)CO2 0.763 0.68 0.466 0.589 0.742 0.596 0.39 0.983 0.396 0.522 0.372 Compound_2389 OC(=O)C=Cc1ccc(cn1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C 0.674 0.746 0.35 0.588 0.783 0.687 0.953 0.918 0.436 0.461 0.815 Compound_2390 COC(=O)C1C(=N)Oc2c(C1c1ccc(cc1)OCc1ccc(cc1)C)ccc(c2)O 0.488 0.824 0.682 0.707 0.991 0.949 0.975 0.545 0.467 0.108 0.648 Compound_2391 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)F)C#N 0.574 0.615 0.471 0.542 0.983 0.545 0.867 0.971 0.439 0.83 0.704 Compound_2392 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)N(CC)C(=O)CO2 0.771 0.72 0.324 0.58 0.742 0.596 0.39 0.98 0.362 0.55 0.48 Compound_2393 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)C(=O)C 0.912 0.402 0.162 0.872 0.756 0.785 0.937 0.859 0.525 0.796 0.789 Compound_2394 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccccc1 0.418 0.632 0.048 0.356 0.91 0.946 0.733 0.921 0.542 0.52 0.309 Compound_2395 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)OC(=O)C(C)(C)C)c1ccccc1C(C)C 0.714 0.627 0.555 0.664 0.924 0.734 0.992 0.825 0.34 0.965 0.818 Compound_2396 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)NC(=O)CO2 0.714 0.581 0.131 0.564 0.727 0.53 0.297 0.966 0.351 0.952 0.49 Compound_2397 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)OCC(F)(F)F 0.562 0.644 0.319 0.556 0.992 0.834 0.872 0.978 0.142 0.58 0.559 Compound_2398 Oc1cccc(c1)N1C(=O)CSC1=NN=C1C(=O)Nc2c1cccc2 0.595 0.562 0.792 0.535 0.828 0.476 0.843 0.113 0.372 0.063 0.333 Compound_2399 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cns2 0.674 0.573 0.559 0.536 0.745 0.705 0.677 0.972 0.206 0.861 0.588 Compound_2400 Oc1ccc(c(c1)Cl)C1NC=NC1c1c(Cl)cc(cc1Cl)O 0.347 0.681 0.108 0.537 0.619 0.689 0.018 0.256 0.364 0.564 0.928 Compound_2401 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(cc1)S(F)(F)(F)(F)F 0.419 0.636 0.184 0.53 0.975 0.714 0.679 0.964 0.126 0.684 0.563 Compound_2402 COc1ccc(cc1)c1cn(c2ccc(cc2)O)c(=O)c2c1cc(O)cc2O 0.682 0.817 0.623 0.674 0.969 0.961 0.447 0.97 0.738 0.087 0.316 Compound_2403 CCCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.877 0.754 0.302 0.572 0.993 0.997 0.261 0.992 0.83 0.928 0.868 Compound_2404 C#CC(C(c1ccc(cc1)O)C#C)c1ccc(cc1)O 0.691 0.775 0.643 0.541 0.888 0.916 0.996 0.759 0.305 0.651 0.83 Compound_2405 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(nc1)C(F)(F)F 0.523 0.607 0.217 0.505 0.933 0.435 0.975 0.922 0.222 0.624 0.488 Compound_2406 Oc1ccc(cc1)CCc1ccc(cc1)O 0.636 0.716 0.592 0.627 0.889 0.972 0.99 0.761 0.532 0.581 0.74 Compound_2407 N#Cc1cc(O)cc2c1c(=O)n(cc2Br)c1ccc(cc1)O 0.655 0.75 0.37 0.587 0.883 0.81 0.78 0.932 0.861 0.443 0.517 Compound_2408 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(c(c1)C(F)(F)F)OCC 0.647 0.722 0.348 0.555 0.904 0.536 0.902 0.971 0.282 0.213 0.624 Compound_2409 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc2c(c1)cccc2 0.947 0.415 0.173 0.791 0.882 0.757 0.961 0.815 0.511 0.364 0.674 Compound_2410 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(C)c(cc1C)OCC 0.612 0.662 0.505 0.543 0.924 0.929 0.158 0.978 0.327 0.706 0.649 Compound_2411 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2F)C(=O)O)c1ccc(cc1Cl)Cl 0.439 0.628 0.245 0.369 0.987 0.862 0.951 0.857 0.473 0.612 0.534 Compound_2412 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc2c(c1)nco2 0.476 0.679 0.362 0.437 0.76 0.641 0.998 0.902 0.534 0.958 0.577 Compound_2413 N#CCc1ccccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.817 0.662 0.696 0.576 0.921 0.715 0.976 0.888 0.8 0.605 0.734 Compound_2414 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)F)C(=O)NC 0.628 0.656 0.183 0.524 0.874 0.94 0.771 0.97 0.384 0.293 0.3 Compound_2415 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)N(CCO2)C(=O)OC(C)(C)C 0.792 0.697 0.072 0.518 0.903 0.637 0.842 0.924 0.377 0.994 0.601 Compound_2416 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)C)OC(F)(F)F 0.625 0.631 0.615 0.528 0.98 0.843 0.866 0.959 0.245 0.31 0.4 Compound_2417 C=Cc1cn(c2ccc(cc2)O)c(=O)c2c1cc(O)cc2O 0.645 0.789 0.24 0.478 0.961 0.981 0.915 0.794 0.877 0.264 0.619 Compound_2418 N#CC(=Cc1ccc(cc1)O)c1ccc(cc1)O 0.696 0.82 0.319 0.67 0.954 0.741 0.982 0.96 0.904 0.549 0.993 Compound_2419 O=NCc1ccc(c2c1cccc2)c1ccc(cc1)O 0.673 0.725 0.93 0.711 0.926 1.0 0.571 0.993 0.727 0.627 0.727 Compound_2420 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(nc1F)O 0.634 0.632 0.563 0.521 0.894 0.541 0.779 0.966 0.222 0.767 0.464 Compound_2421 CCCCCCCCCCCCNc1c(Cc2ccccc2C)c(=O)oc2c1cccc2 0.494 0.688 0.943 0.439 0.25 0.936 0.787 0.892 0.888 0.363 0.615 Compound_2422 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)c(C)cc(c2C)O 0.87 0.534 0.327 0.816 0.728 0.742 0.931 0.947 0.499 0.744 0.89 Compound_2423 Oc1ccc2c(c1)c(C(=O)c1ccc(cc1)OCCN1CCCCC1)c(s2)c1ccc(cc1)O 0.91 0.338 0.21 0.89 0.796 0.747 0.923 0.813 0.511 0.967 0.918 Compound_2424 CCSCc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.845 0.487 0.387 0.859 0.842 0.789 0.961 0.703 0.361 0.16 0.69 Compound_2425 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccncc1 0.896 0.439 0.164 0.752 0.777 0.75 0.954 0.838 0.461 0.467 0.763 Compound_2426 COc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cccc2 0.865 0.512 0.202 0.738 0.754 0.739 0.96 0.104 0.522 0.074 0.561 Compound_2427 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccn(=O)cc1 0.883 0.498 0.26 0.804 0.798 0.73 0.976 0.857 0.461 0.884 0.738 Compound_2428 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1cc(C)c(c(c1)C)O 0.915 0.534 0.138 0.802 0.777 0.739 0.934 0.875 0.511 0.744 0.89 Compound_2429 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)c1ccccc1 0.947 0.415 0.173 0.824 0.895 0.765 0.961 0.79 0.511 0.364 0.674 Compound_2430 CC=Cc1cn(c2ccc(cc2)O)c(=O)c2c1cc(O)cc2O 0.717 0.798 0.322 0.533 0.898 0.769 0.316 0.956 0.798 0.15 0.5 Compound_2431 CCOC(=O)C=Cc1ccc(c(c1)C)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.903 0.713 0.952 0.827 0.901 0.773 0.974 0.919 0.681 0.929 0.884 Compound_2432 BrCC(=O)NCCC1CC2(C)C(O)CCC2C2C1c1ccc(cc1CC2)O 0.41 0.783 0.008 0.404 0.84 0.852 0.084 0.891 0.193 0.05 0.366 Compound_2433 FCCCNCCOc1cc(ccc1C)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1 0.45 0.628 0.108 0.265 0.911 0.682 0.924 0.471 0.383 0.074 0.728 Compound_2434 O=C1CCC2(C(=C1c1ccc(cc1)OCCN1CCCCC1)c1ccc3c(c1C2)c[nH]n3)Cc1ccccc1 0.69 0.682 0.322 0.416 0.918 0.721 0.98 0.477 0.367 0.055 0.376 Compound_2435 CCCc1nnc(o1)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C)F 0.875 0.673 0.756 0.733 0.79 0.661 0.99 0.951 0.552 0.044 0.608 Compound_2436 CCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)CC 0.732 0.87 0.143 0.473 0.693 0.625 0.791 0.7 0.577 0.807 0.85 Compound_2437 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc(c(c1)Cl)OC(F)(F)F 0.588 0.64 0.469 0.532 0.966 0.675 0.577 0.955 0.271 0.765 0.698 Compound_2438 Oc1ccc(cc1)n1cc(c2ccccc2)c2c(c1=O)c(O)cc(c2)O 0.781 0.808 0.749 0.694 0.988 0.98 0.936 0.963 0.907 0.264 0.674 Compound_2439 N#CCC(c1ccc(cc1)O)Cc1ccc(cc1)O 0.571 0.753 0.176 0.585 0.962 0.847 0.992 0.853 0.375 0.179 0.93 Compound_2440 CCOc1cc(F)ccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.872 0.601 0.938 0.628 0.907 0.742 0.972 0.963 0.668 0.921 0.714 Compound_2441 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)F 0.949 0.619 0.874 0.843 0.918 0.747 0.995 0.963 0.862 0.819 0.49 Compound_2442 CCC1=C2c3ccc4c(c3CC2(CCC1=O)CC)[nH]nn4 0.705 0.9 0.143 0.483 0.693 0.625 0.791 0.712 0.602 0.879 0.884 Compound_2443 OCCc1c(O)ccc2c1CCC1C2CCC2(C1CCC2O)C 0.836 0.845 0.183 0.523 0.972 0.989 0.006 0.399 0.033 0.946 0.723 Compound_2444 O=NCc1ccc(c2c1cccc2)c1ccc(c(c1)F)O 0.75 0.62 0.886 0.686 0.926 0.994 0.628 0.994 0.692 0.755 0.811 Compound_2445 CCC(C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CCOCCON=Cc1ccc(c(c1)C(=O)N)O)C)c1ccccc1 0.633 0.601 0.065 0.484 0.879 0.951 0.971 0.071 0.291 0.395 0.449 Compound_2446 CCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC)CC 0.665 0.533 0.171 0.596 0.757 0.978 0.006 0.638 0.111 0.537 0.385 Compound_2447 CCC(C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CCOCCOCCON=Cc1ccc(c(c1)C(=O)N)O)C)c1ccccc1 0.604 0.601 0.065 0.484 0.879 0.951 0.971 0.071 0.291 0.395 0.449 Compound_2448 O=S1C2C(=C(C1c1c2c(O)n(c1O)c1ccccc1)c1ccc(cc1C)O)c1ccc(cc1C)O 0.714 0.824 0.335 0.62 0.894 0.636 0.842 0.557 0.707 0.982 0.541 Compound_2449 N#CC(C(c1cccc(c1)O)C#N)c1ccc(cc1)O 0.786 0.778 0.599 0.612 0.955 0.704 0.989 0.911 0.267 0.373 0.974 Compound_2450 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1=CCN(CC1)C(=O)OC(C)(C)C 0.586 0.707 0.263 0.477 0.846 0.818 0.906 0.88 0.346 0.993 0.5 Compound_2451 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cc(F)nc(c1)C(C)(C)C 0.606 0.74 0.354 0.506 0.982 0.922 0.863 0.987 0.399 0.981 0.5 Compound_2452 O=NCc1ccc(c2c1occ2)c1ccc(cc1)O 0.188 0.69 0.873 0.611 0.216 0.956 0.607 0.961 0.457 0.618 0.648 Compound_2453 FCCCN1CC(C1)Nc1ccc(cn1)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.497 0.697 0.816 0.239 0.714 0.677 0.987 0.585 0.382 0.021 0.311 Compound_2454 CNC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(c(c1)C)O 0.655 0.792 0.882 0.778 0.833 0.744 0.937 0.96 0.589 0.737 0.728 Compound_2455 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)C(F)(F)F 0.752 0.816 0.132 0.665 0.8 0.638 0.862 0.954 0.511 0.943 0.78 Compound_2456 FCCCNCCOc1ccc(c(c1)C1N(CC(F)(F)F)C(C)Cc2c1[nH]c1c2cccc1)CO 0.515 0.562 0.219 0.253 0.946 0.67 0.808 0.159 0.18 0.216 0.648 Compound_2457 CCc1c2ccc(c3n2c(c1c1ccccc1)cc3)O 0.423 0.717 0.188 0.74 0.743 0.655 0.917 0.99 0.697 0.733 0.819 Compound_2458 Oc1ccc(cc1)C1=c2ccc3=CC=CC(C1CCc1ccccc1)n23 0.57 0.679 0.156 0.536 0.95 0.972 0.304 0.783 0.62 0.819 0.762 Compound_2459 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)cno2 0.517 0.629 0.559 0.536 0.898 0.797 0.952 0.972 0.289 0.656 0.551 Compound_2460 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)ocn2 0.461 0.693 0.842 0.555 0.787 0.642 0.994 0.949 0.207 0.679 0.529 Compound_2461 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)C1=CCNCC1 0.531 0.467 0.117 0.44 0.791 0.577 0.129 0.87 0.151 0.304 0.332 Compound_2462 FCC(CN1C(c2c(F)cc(cc2F)C=CC(=O)O)c2[nH]c3c(c2CC1(C)C)cccc3)C 0.429 0.679 0.103 0.36 0.901 0.738 0.995 0.721 0.467 0.521 0.257 Compound_2463 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(=O)N 0.885 0.423 0.12 0.826 0.803 0.747 0.974 0.629 0.439 0.598 0.892 Compound_2464 CCOP(=O)(c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O)OCC 0.812 0.617 0.238 0.856 0.817 0.595 0.933 0.931 0.445 0.495 0.653 Compound_2465 Oc1ccc(cc1)C=C(c1ccc(cc1)O)c1ccc(cc1)O 0.886 0.825 0.73 0.693 0.995 1.0 0.888 0.953 0.872 0.653 0.987 Compound_2466 Oc1ccc(cc1)C(=C1CCCCC1)c1ccc(cc1)OCCN(C(C)C)C(C)C 0.666 0.553 0.25 0.601 0.888 0.989 0.004 0.44 0.313 0.454 0.372 Compound_2467 FC1CCN(C1)C(COc1ccc(cc1)C1Oc2ccc(cc2C(=C1c1cccc(c1)O)C)O)C 0.547 0.73 0.184 0.489 0.974 0.679 0.024 0.888 0.152 0.822 0.734 Compound_2468 CCCCCSCCCCCCCCCCC(=C(c1cccc(c1)O)CC)c1ccc(cc1)O 0.876 0.674 0.328 0.586 0.969 0.944 0.866 0.969 0.388 0.994 0.984 Compound_2469 CCCCC1C2C=CC=c3n2c(=C1c1ccc(cc1)O)cc3 0.617 0.656 0.128 0.547 0.579 0.958 0.054 0.929 0.823 0.64 0.82 Compound_2470 C=Cc1cn(c2ccc(c(c2)F)O)c(=O)c2c1cc(O)cc2O 0.69 0.723 0.168 0.5 0.965 0.969 0.92 0.934 0.824 0.322 0.463 Compound_2471 CCOP(=O)(c1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O)OCC 0.887 0.617 0.249 0.859 0.823 0.643 0.933 0.937 0.416 0.495 0.653 Compound_2472 CC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)C(F)(F)F 0.933 0.635 0.96 0.804 0.932 0.77 0.867 0.989 0.835 0.97 0.818 Compound_2473 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1nnnn1C)c1ccc(cc1)F 0.932 0.706 0.889 0.769 0.741 0.714 0.246 0.97 0.914 0.977 0.625 Compound_2474 CC(Oc1cc(F)ccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O)C 0.869 0.691 0.931 0.634 0.903 0.736 0.957 0.922 0.868 0.91 0.528 Compound_2475 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)NCCO2 0.685 0.581 0.824 0.435 0.909 0.45 0.049 0.919 0.338 0.351 0.545 Compound_2476 Oc1ccc2c(c1)oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F 0.7 0.663 0.956 0.633 0.833 0.411 0.953 0.93 0.349 0.062 0.859 Compound_2477 CCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O 0.9 0.735 0.302 0.58 0.993 0.997 0.261 0.996 0.882 0.934 0.905 Compound_2478 CCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)C(F)(F)F 0.714 0.856 0.132 0.671 0.786 0.629 0.869 0.95 0.498 0.521 0.817 Compound_2479 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)C(=O)O)c1ccc(c(c1)F)Cl 0.419 0.628 0.485 0.378 0.97 0.876 0.951 0.951 0.511 0.612 0.534 Compound_2480 COc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.914 0.452 0.252 0.851 0.833 0.732 0.923 0.644 0.517 0.44 0.745 Compound_2481 CNC(=O)C=Cc1ccc(cn1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.576 0.764 0.592 0.688 0.742 0.69 0.952 0.983 0.492 0.495 0.855 Compound_2482 O=NCc1c(Cl)cc(cc1Cl)c1ccc(c(c1)F)O 0.911 0.593 0.573 0.716 0.944 0.907 0.206 0.984 0.653 0.652 0.844 Compound_2483 O=NCc1c(C)n(c2c1cccc2)c1ccc(cc1)O 0.51 0.672 0.412 0.531 0.941 0.941 0.876 0.847 0.462 0.845 0.814 Compound_2484 OCCc1cc2c(cc1O)CCC1C2CCC2(C1CCC2O)C 0.795 0.845 0.197 0.486 0.957 0.989 0.007 0.437 0.104 0.946 0.723 Compound_2485 OC(=O)c1cccc2c1NC(c1cccc(c1)N(=O)=O)C1C2C=CC1 0.675 0.66 0.207 0.496 0.642 0.583 0.375 0.611 0.555 0.25 0.869 Compound_2486 FCCCN1CCC(C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1ccc2c(c1)nc([nH]2)C 0.551 0.536 0.922 0.483 0.749 0.699 0.958 0.975 0.302 0.726 0.5 Compound_2487 COc1ccc(c(n1)C)c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.78 0.81 0.905 0.661 0.86 0.753 0.993 0.955 0.821 0.238 0.809 Compound_2488 O=NCc1c(C)n(c2c1cccc2)c1ccc(c(c1)F)O 0.604 0.675 0.191 0.506 0.953 0.928 0.896 0.956 0.435 0.883 0.804 Compound_2489 Cc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.866 0.442 0.24 0.849 0.758 0.793 0.943 0.838 0.511 0.177 0.533 Compound_2490 COc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)OC 0.879 0.578 0.14 0.789 0.765 0.718 0.967 0.2 0.535 0.267 0.781 Compound_2491 CCC(C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CCON=Cc1ccc(c(c1)C(=O)N)O)C)c1ccccc1 0.664 0.621 0.067 0.475 0.878 0.96 0.966 0.05 0.254 0.372 0.495 Compound_2492 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cccc2O 0.849 0.338 0.154 0.822 0.762 0.652 0.94 0.839 0.483 0.967 0.918 Compound_2493 CCC(=C(c1ccc(cc1)O)CCCCCC(=O)N(CCCSCCCC(C(F)(F)F)(F)F)C)c1ccc(cc1)O 0.648 0.608 0.38 0.672 0.907 0.929 0.752 0.929 0.332 0.146 0.687 Compound_2494 BrCC(=O)NCCCCC1CC2(C)C(O)CCC2C2C1c1ccc(cc1CC2)O 0.512 0.783 0.007 0.416 0.839 0.879 0.095 0.883 0.343 0.05 0.366 Compound_2495 CCCOC(=O)C1=CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.974 0.9 0.143 0.679 0.994 0.99 0.185 0.909 0.236 0.983 0.957 Compound_2496 CCCn1nnnc1C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1C)F 0.847 0.589 0.758 0.739 0.715 0.703 0.585 0.985 0.741 0.305 0.538 Compound_2497 CC(OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1C(C)C)C 0.855 0.723 0.755 0.769 0.925 0.742 0.986 0.978 0.767 0.973 0.569 Compound_2498 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(=O)O 0.888 0.352 0.117 0.767 0.849 0.729 0.962 0.806 0.353 0.927 0.883 Compound_2499 Fc1ccc(cc1)c1c(=O)c2ccc(cc2oc1C(F)(F)F)O 0.811 0.767 0.913 0.732 0.991 0.973 0.998 0.989 0.491 0.164 0.865 Compound_2500 CCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)CCC 0.732 0.87 0.268 0.481 0.693 0.625 0.791 0.641 0.577 0.807 0.85 Compound_2501 CNC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)F 0.706 0.662 0.85 0.753 0.864 0.732 0.944 0.959 0.668 0.835 0.661 Compound_2502 Oc1cc(O)c2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.896 0.385 0.209 0.859 0.852 0.725 0.972 0.908 0.547 0.947 0.871 Compound_2503 COc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cc(c(c2OC)OC)OC 0.734 0.692 0.147 0.779 0.681 0.641 0.962 0.239 0.578 0.293 0.789 Compound_2504 CCCC1=C2c3ccc4c(c3CC2(CCC1=O)CC)[nH]nn4 0.705 0.91 0.268 0.493 0.693 0.625 0.791 0.641 0.638 0.879 0.864 Compound_2505 Oc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)O)CCC(F)(F)F 0.483 0.412 0.326 0.645 0.762 0.594 0.944 0.783 0.179 0.088 0.473 Compound_2506 FCCCN1CC(C1)Nc1ncc(c(c1)OC)C1N(CC2(F)CC2)C(C)Cc2c1ccc1c2cn[nH]1 0.547 0.646 0.923 0.3 0.735 0.67 0.974 0.568 0.511 0.183 0.493 Compound_2507 O=C(C1Cc2ccccc2CN1C(=O)c1ccco1)Nc1cc(ccc1N1CCOCC1)C(F)(F)F 0.519 0.577 0.31 0.393 0.306 0.556 0.976 0.805 0.403 0.418 0.463 Compound_2508 CCc1c2cccc3n2c(c1c1cccc(c1)O)cc3 0.494 0.737 0.263 0.738 0.859 0.655 0.873 0.981 0.273 0.673 0.865 Compound_2509 COc1ccc(c(c1)C(C)C)c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.791 0.761 0.6 0.653 0.922 0.732 0.995 0.904 0.713 0.958 0.784 Compound_2510 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)CC 0.726 0.91 0.143 0.487 0.693 0.625 0.791 0.798 0.613 0.879 0.864 Compound_2511 FCC(CN1C(C)Cc2c(C1c1c(F)cc(cc1F)C=CC(=O)O)[nH]c1c2cccc1)C 0.409 0.61 0.117 0.352 0.921 0.738 0.995 0.58 0.464 0.071 0.129 Compound_2512 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cc(c(c2)O)O 0.935 0.466 0.216 0.879 0.786 0.664 0.76 0.886 0.511 0.935 0.897 Compound_2513 COc1cccc2c1c(=O)c1c(o2)cc(cc1)O 0.718 0.89 0.956 0.687 0.849 0.601 0.989 0.723 0.877 0.144 0.888 Compound_2514 Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)C=Cc1n[nH]c(=O)o1)c1ccc(cc1C)F 0.732 0.6 0.979 0.616 0.852 0.699 0.888 0.829 0.463 0.7 0.612 Compound_2515 O=C1C(=CNc2ccc(cc2)S(=O)(=O)N)C(=O)N(C(=O)N1C1CCCCC1)C1CCCCC1 0.317 0.368 0.0 0.137 0.413 0.385 0.021 0.009 0.39 0.009 0.191 Compound_2516 OC(=O)C=Cc1cc(F)c(c(c1)F)C1c2[nH]c3c(c2CC(N1CC(F)(C)C)(C)C)cccc3 0.42 0.674 0.108 0.377 0.899 0.737 0.994 0.568 0.482 0.449 0.238 Compound_2517 CCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)C 0.737 0.91 0.143 0.463 0.693 0.625 0.791 0.7 0.577 0.879 0.864 Compound_2518 CC1CC(C)(C)CC(C1)(c1ccc(cc1)O)c1ccc(cc1)O 0.977 0.687 0.401 0.494 0.988 0.997 0.971 0.619 0.564 0.932 0.881 Compound_2519 Oc1ccc(cc1)CC(C(=O)C(F)(F)F)c1ccc(cc1)O 0.615 0.715 0.477 0.632 0.966 0.952 0.999 0.936 0.362 0.634 0.927 Compound_2520 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cc(c(c2C)O)C 0.863 0.534 0.122 0.829 0.796 0.72 0.944 0.906 0.511 0.744 0.89 Compound_2521 COc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc2c(c1)OCO2 0.83 0.654 0.676 0.748 0.736 0.692 0.919 0.219 0.473 0.346 0.777 Compound_2522 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)N(=O)=O 0.955 0.533 0.287 0.879 0.932 0.733 0.99 0.835 0.407 0.968 0.679 Compound_2523 CCN(CCOc1ccc(cc1)C(=CC(C)C)c1ccc(cc1)O)CC 0.534 0.57 0.546 0.737 0.777 0.949 0.006 0.886 0.047 0.096 0.251 Compound_2524 Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1c(c2)O 0.926 0.338 0.182 0.801 0.788 0.716 0.932 0.851 0.526 0.967 0.918 Compound_2525 CCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC 0.668 0.52 0.09 0.674 0.757 0.978 0.006 0.856 0.109 0.088 0.251 Compound_2526 CCC(=C(c1ccc(cc1)OCN(C)C)Cc1ccccc1)c1ccccc1 0.465 0.583 0.018 0.34 0.747 0.99 0.084 0.875 0.262 0.628 0.429 Compound_2527 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)Br 0.72 0.816 0.139 0.661 0.77 0.643 0.807 0.909 0.604 0.982 0.758 Compound_2528 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1CN1CCCC1=O)F 0.675 0.526 0.689 0.529 0.826 0.705 0.927 0.934 0.487 0.928 0.614 Compound_2529 OC(=O)c1cccc2c1NC(c1ccc(c(c1)N(=O)=O)O)C1C2C=CC1 0.722 0.742 0.069 0.451 0.881 0.765 0.619 0.908 0.516 0.437 0.913 Compound_2530 CCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)Br 0.71 0.85 0.139 0.646 0.77 0.643 0.807 0.889 0.571 0.971 0.765 Compound_2531 COc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)CO 0.731 0.421 0.533 0.778 0.773 0.731 0.959 0.519 0.442 0.11 0.657 Compound_2532 Fc1ccc2c(c1)c1ccc3c(c1C(=C1SCCCS1)O2)C(=CC(N3)(C)C)C 0.464 0.736 0.949 0.585 0.798 0.801 0.874 0.935 0.532 0.996 0.757 Compound_2533 CCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)C 0.696 0.856 0.143 0.473 0.693 0.625 0.791 0.712 0.602 0.33 0.876 Compound_2534 CCCCC1=C2c3ccc4c(c3CC2(CCC1=O)CC)[nH]nn4 0.721 0.91 0.268 0.507 0.693 0.625 0.791 0.752 0.698 0.879 0.864 Compound_2535 Oc1ccc(cc1)c1cc2n3c1ccc3ccc2 0.929 0.742 0.751 0.766 0.915 0.756 0.74 0.89 0.945 0.974 0.882 Compound_2536 Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O 0.925 0.821 0.982 0.736 0.905 0.995 0.993 0.987 0.933 0.342 0.918 Compound_2537 O=Cc1cc2c(cc1O)CCC1C2CCC2(C1CCC2O)C 0.961 0.94 0.005 0.512 0.916 0.994 0.147 0.752 0.345 0.99 0.719 Compound_2538 Brc1cc2OCOc2cc1C1Nc2ccccc2C2C1CC=C2 0.723 0.651 0.94 0.639 0.689 0.627 0.17 0.745 0.43 0.752 0.752 Compound_2539 CCCCCSCCCCCCCCCCC(=C(c1ccc(cc1)O)CC)c1ccc(cc1)O 0.87 0.674 0.216 0.581 0.963 0.981 0.501 0.952 0.483 0.994 0.984 Compound_2540 O=NCc1ccc(cc1F)c1ccc(cc1)O 0.83 0.556 0.786 0.748 0.685 0.975 0.769 0.959 0.704 0.576 0.716 Compound_2541 COc1ccc(cc1)C(=O)Oc1cccc2c1cccc2O 0.85 0.721 0.633 0.728 0.987 0.881 0.983 0.057 0.831 0.401 0.648 Compound_2542 OC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccoc1C 0.722 0.708 0.791 0.587 0.757 0.721 0.99 0.932 0.729 0.932 0.663 Compound_2543 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)c1ccco1 0.674 0.836 0.1 0.415 0.723 0.684 0.99 0.284 0.437 0.504 0.784 Compound_2544 C#Cc1ccccc1c1sc2c(c1Oc1ccc(cc1)C=CC(=O)O)ccc(c2)O 0.877 0.738 0.724 0.613 0.894 0.71 0.977 0.861 0.751 0.873 0.575 Compound_2545 OC(=O)C=Cc1ccc(cc1)Oc1c2ccc(cc2sc1c1cccc2c1ccn2C)O 0.833 0.737 0.725 0.648 0.87 0.726 0.996 0.785 0.771 0.652 0.811 Compound_2546 CCCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC 0.756 0.52 0.09 0.674 0.757 0.978 0.006 0.856 0.121 0.088 0.251 Compound_2547 CCCC(C1C2C=CC=c3n2c(=C1c1ccc(cc1)O)cc3)C 0.617 0.68 0.128 0.558 0.558 0.944 0.067 0.891 0.735 0.607 0.852 Compound_2548 FCC(CN1C(C)Cc2c(C1c1ccc(cc1)C=CC(=O)O)[nH]c1c2cccc1)C 0.457 0.64 0.219 0.26 0.891 0.747 0.985 0.528 0.503 0.047 0.304 Compound_2549 Oc1ccc(cc1)n1cc(Br)c2c(c1=O)ccc(c2)O 0.721 0.707 0.513 0.563 0.864 0.919 0.641 0.587 0.891 0.483 0.685 Compound_2550 COC(=O)c1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)cccc2 0.812 0.496 0.081 0.713 0.773 0.691 0.987 0.07 0.511 0.484 0.7 Compound_2551 COC(=O)c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccccc1 0.807 0.496 0.065 0.713 0.713 0.713 0.987 0.123 0.529 0.484 0.7 Compound_2552 COc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)OCCN1CCCCC1)ccc(c2)O 0.941 0.452 0.304 0.851 0.833 0.732 0.923 0.719 0.511 0.44 0.745 Compound_2553 Clc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O 0.878 0.439 0.307 0.739 0.786 0.689 0.87 0.777 0.535 0.478 0.836 Compound_2554 Oc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(F)(F)F 0.94 0.429 0.246 0.783 0.887 0.74 0.989 0.862 0.43 0.401 0.807 Compound_2555 COC(=O)c1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(=O)OC 0.807 0.591 0.065 0.764 0.738 0.724 0.987 0.127 0.522 0.264 0.751 Compound_2556 Oc1ccc2c(c1)oc(=O)c(c2C(F)(F)F)Cc1ccccc1 0.845 0.539 0.665 0.518 0.984 0.967 0.999 0.912 0.804 0.807 0.916 Compound_2557 COc1ccc2c(c1)sc(c2C(=O)c1ccc(cc1)CCCN1CCCCC1)c1ccc(cc1)OC 0.672 0.683 0.053 0.614 0.684 0.788 0.977 0.462 0.614 0.017 0.453 Compound_2558 OC(=O)c1cc(Cl)c2c(c1)C1C=CCC1C(N2)c1ccc(cc1)S(=O)(=O)N1CCOCC1 0.628 0.56 0.03 0.334 0.614 0.59 0.647 0.671 0.392 0.682 0.569 Compound_2559 O=NC1C(c2ccc(cc2)O)C(Oc2c1ccc(c2)O)c1ccc(cc1)OCCN1CCCCC1 0.368 0.717 0.158 0.516 0.889 0.846 0.106 0.374 0.26 0.83 0.814 Compound_2560 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)CCC 0.726 0.866 0.268 0.496 0.693 0.625 0.791 0.752 0.613 0.879 0.846 Compound_2561 Clc1ccc(c(c1)Cl)C(=O)Oc1cccc2c1cccc2O 0.858 0.532 0.742 0.755 0.986 0.78 0.975 0.748 0.637 0.966 0.973 Compound_2562 CCCCCSCCCCCCCCCCC(=C(c1ccc(cc1)O)CC)c1cccc(c1)O 0.883 0.674 0.328 0.586 0.969 0.944 0.866 0.969 0.388 0.994 0.984 Compound_2563 Clc1ccc(cc1)C1Nc2c(ccc(c2C2C1CC=C2)N(=O)=O)C(=O)O 0.58 0.691 0.397 0.423 0.703 0.464 0.614 0.689 0.463 0.561 0.892 Compound_2564 CCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)Br 0.685 0.806 0.139 0.661 0.759 0.636 0.541 0.881 0.58 0.829 0.8 Compound_2565 CCN(CCOc1ccc(cc1)C(=CCc1ccccc1)c1ccc(cc1)O)CC 0.559 0.544 0.634 0.677 0.958 0.984 0.004 0.784 0.076 0.096 0.271 Compound_2566 CCc1c2cc(O)cc3n2c(c1c1ccccc1)cc3 0.6 0.73 0.29 0.715 0.898 0.679 0.92 0.96 0.775 0.673 0.856 Compound_2567 O=NCc1ccc(c2c1cco2)c1ccc(cc1)O 0.144 0.671 0.85 0.654 0.19 0.953 0.301 0.901 0.457 0.618 0.647 Compound_2568 COc1ccc(cc1)C(=O)NN=C(c1ccc2c(c1)C1C=CCC1C(N2)c1ccccc1)C 0.765 0.808 0.919 0.642 0.786 0.898 0.911 0.748 0.415 0.144 0.469 Compound_2569 FCC(CN1C(c2ccc(cc2F)C=CC(=O)O)c2[nH]c3c(c2CC1(C)C)cccc3)C 0.482 0.679 0.299 0.35 0.901 0.738 0.995 0.705 0.53 0.521 0.257 Compound_2570 CN(CCOc1ccc(c(c1)Cl)C1NC=NC1c1ccc(cc1Cl)O)C 0.368 0.504 0.017 0.582 0.549 0.655 0.005 0.18 0.125 0.072 0.371 Compound_2571 CCCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(C)C 0.755 0.46 0.006 0.647 0.792 0.951 0.004 0.757 0.49 0.027 0.218 Compound_2572 FCC(CN1C(c2ccc(cc2)C=CC(=O)O)c2[nH]c3c(c2CC1(C)C)cccc3)C 0.477 0.709 0.168 0.268 0.864 0.746 0.985 0.677 0.524 0.436 0.458 Compound_2573 Oc1ccc(cc1)n1cc(Br)c2c(c1=O)c(cc(c2)O)C(=O)O 0.648 0.617 0.078 0.441 0.869 0.865 0.905 0.279 0.735 0.388 0.569 Compound_2574 COCC1(OC)CCC2C1(C)CC(c1ccc(cc1)CN=O)C1=C3CCC(=O)C=C3CCC21 0.888 0.91 0.381 0.535 0.727 0.979 0.746 0.948 0.295 0.475 0.482 Compound_2575 CCCCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC 0.799 0.533 0.09 0.674 0.757 0.978 0.006 0.856 0.191 0.537 0.385 Compound_2576 O=NCc1cn(c2c1cccc2)c1ccc(cc1)O 0.372 0.626 0.348 0.535 0.799 0.87 0.516 0.823 0.86 0.85 0.847 Compound_2577 Oc1ccc(cc1)n1cc(c2ccccc2)c2c(c1=O)ccc(c2)O 0.772 0.786 0.756 0.7 0.994 0.983 0.889 0.933 0.881 0.24 0.645 Compound_2578 CC(N(C(C)C)CCOc1ccc(cc1)C(=C1CCCCC1)c1ccc(cc1)OCCN(C(C)C)C(C)C)C 0.523 0.575 0.159 0.495 0.785 0.981 0.006 0.4 0.302 0.647 0.35 Compound_2579 CC(c1ccc(cc1)O)(c1cccc(c1)C(c1ccc(cc1)O)(C)C)C 0.943 0.591 0.751 0.648 0.995 1.0 0.823 0.938 0.69 0.941 0.891 Compound_2580 OC(=O)C=Cc1ccc(cc1)C1c2[nH]c3c(c2CC(N1CC(F)(C)C)(C)C)cccc3 0.462 0.694 0.176 0.275 0.861 0.745 0.983 0.545 0.566 0.367 0.37 Compound_2581 CCC(C(=O)Nc1nc2c(s1)cc(cc2)OC)C 0.576 0.728 0.947 0.701 0.309 0.888 0.112 0.466 0.72 0.835 0.546 Compound_2582 Oc1ccc(cc1)S(=O)(=O)N(C1CC1)CC(c1ccccc1)(O)C 0.06 0.5 0.232 0.51 0.347 0.494 0.013 0.091 0.32 0.369 0.226 Compound_2583 COC(=O)C(N1C(=O)SC(=Cc2ccc(c(c2)Cl)O)C1=O)C 0.505 0.69 0.36 0.651 0.804 0.423 0.273 0.894 0.366 0.97 0.208 Compound_2584 CCC(=C(c1ccccc1)Cc1ccccc1)c1ccc(cc1)OCN1CCCCC1 0.271 0.579 0.05 0.285 0.379 0.979 0.006 0.612 0.313 0.582 0.262 Compound_2585 O=NCc1cc(O)ccc1c1noc2c1ccc(c2)O 0.517 0.728 0.957 0.682 0.931 0.923 0.832 0.997 0.824 0.701 0.868 Compound_2586 CCC(=C(c1ccccc1)Cc1ccc(cc1)OCN1CCOCC1)c1ccccc1 0.31 0.619 0.067 0.332 0.753 0.898 0.006 0.722 0.2 0.6 0.239 Compound_2587 COc1cccc(c1OC)C1Nc2c(C3C1CC=C3)cc(cc2C(=O)O)Br 0.729 0.693 0.484 0.403 0.645 0.652 0.721 0.39 0.446 0.062 0.723 Compound_2588 NCCc1c(O)ccc2c1CCC1C2CCC2(C1CCC2O)C 0.808 0.8 0.006 0.364 0.798 0.983 0.059 0.29 0.044 0.005 0.382 Compound_2589 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Sc1ccc(c(c1)N)Cl 0.561 0.91 0.233 0.848 0.743 0.677 0.907 0.093 0.238 0.11 0.66 Compound_2590 OCCCc1c(O)ccc2c1CCC1C2CCC2(C1CCC2O)C 0.909 0.845 0.012 0.538 0.978 0.992 0.009 0.399 0.07 0.946 0.723 Compound_2591 CCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(C)cc(=O)[nH]1 0.294 0.491 0.98 0.55 0.247 0.819 0.761 0.023 0.395 0.094 0.575 Compound_2592 Clc1ccc(cc1)C(=O)COC(=O)c1cccc(c1)O 0.73 0.442 0.907 0.645 0.849 0.798 0.965 0.284 0.366 0.183 0.92 Compound_2593 CC(C=C(c1ccc(cc1)OCCN(C(C)C)C(C)C)c1ccc(cc1)OCCN(C(C)C)C(C)C)C 0.38 0.552 0.412 0.605 0.585 0.963 0.003 0.584 0.284 0.128 0.252 Compound_2594 CCC1C(C)CNc2c1cc1c(c2)oc(=O)cc1C(F)(F)F 0.785 0.593 0.152 0.479 0.509 0.288 0.856 0.592 0.682 0.487 0.749 Compound_2595 CCNc1ccc(cc(c1=O)C(=O)C=Cc1ccccc1Cl)Br 0.505 0.537 0.911 0.544 0.48 0.365 0.05 0.106 0.518 0.764 0.779 Compound_2596 CCCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN1CCCC1 0.694 0.627 0.092 0.663 0.689 0.973 0.017 0.824 0.489 0.866 0.36 Compound_2597 COc1ccc2c(c1)scc2Oc1ccc(cc1)C=CC(=O)OC(C)(C)C 0.89 0.666 0.53 0.816 0.827 0.731 0.99 0.648 0.845 0.987 0.753 Compound_2598 CN(CCOc1ccc(cc1)C1NC=NC1c1ccc(cc1)O)C 0.209 0.545 0.028 0.542 0.094 0.51 0.003 0.087 0.142 0.012 0.213 Compound_2599 OCC1CC2CCC(C1)N2S(=O)(=O)c1ccc(cc1)O 0.46 0.416 0.137 0.552 0.114 0.499 0.003 0.011 0.311 0.049 0.182 Compound_2600 CCCCCCCCC=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(CC)CC 0.836 0.533 0.09 0.674 0.757 0.978 0.006 0.856 0.29 0.537 0.385 Compound_2601 COc1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C(=O)O 0.524 0.526 0.125 0.424 0.63 0.628 0.959 0.785 0.255 0.181 0.278 Compound_2602 Oc1cc(=O)c2c(c1)oc1c(c2O)sc2c1cccc2 0.654 0.808 0.992 0.634 0.658 0.655 0.643 0.902 0.879 0.961 0.822 Compound_2603 Oc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)O 0.952 0.683 0.866 0.634 1.0 0.991 0.997 0.09 0.457 0.881 0.92 Compound_2604 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)CSc1ccc(c(c1)N)Cl 0.57 0.9 0.283 0.831 0.761 0.69 0.889 0.104 0.254 0.19 0.635 Compound_2605 CC(c1c(F)cccc1F)(CN(S(=O)(=O)c1ccc(cc1)O)C1CC1)O 0.087 0.525 0.485 0.578 0.45 0.519 0.376 0.376 0.364 0.745 0.5 Compound_2606 CCCC(c1cnnc(n1)c1ccccc1)N=Nc1ccc(cc1)Cl 0.484 0.693 0.972 0.781 0.5 0.821 0.405 0.924 0.745 0.031 0.16 Compound_2607 COc1cccc(c1)NS(=O)(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C(=O)O 0.523 0.526 0.141 0.432 0.638 0.567 0.982 0.709 0.254 0.129 0.28 Compound_2608 Oc1ccc(cc1)c1cc2ccccc2oc1=O 0.7 0.678 0.947 0.814 0.891 0.996 0.989 0.967 0.838 0.625 0.899 Compound_2609 CC(Cc1cc(O)c(=O)n(c1c1ccnc(c1)Cc1ccccc1)Cc1ccc2c(c1)cccc2)C 0.602 0.645 0.561 0.639 0.588 0.786 0.784 0.992 0.445 0.004 0.161 Compound_2610 N#CC(=Cc1ccc(c(c1)N(=O)=O)N1CCCCC1)c1nc2c([nH]1)cc(cc2)C 0.459 0.697 0.604 0.624 0.657 0.676 0.454 0.968 0.468 0.039 0.791 Compound_2611 C=Cc1cc(O)cc2c1c(=O)n(cn2)c1ccc(cc1)O 0.678 0.792 0.478 0.506 0.915 0.719 0.939 0.966 0.796 0.068 0.388 Compound_2612 Oc1ccc(cc1)C=CC(=O)c1ccc(cc1)Br 0.966 0.739 0.816 0.775 0.315 0.717 0.993 0.951 0.64 0.959 0.973 Compound_2613 Cc1cc(ccc1O)C(c1ccc(c(c1)C)O)(c1ccccc1)C 0.897 0.574 0.842 0.653 0.987 1.0 0.372 0.953 0.564 0.997 0.979 Compound_2614 Oc1ccc(c(c1)Cl)C1NC(=NC1c1c(Cl)cc(cc1Cl)O)C 0.38 0.633 0.062 0.518 0.649 0.634 0.045 0.145 0.414 0.49 0.634 Compound_2615 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Sc1cccc(c1)N 0.523 0.91 0.044 0.869 0.792 0.721 0.956 0.09 0.189 0.062 0.579 Compound_2616 Oc1ccc2c(c1)CCC1C2CCC2(C1CCC2=C)C 0.96 0.789 0.036 0.52 0.986 0.995 0.036 0.762 0.278 0.998 0.979 Compound_2617 CCOC(=O)c1c(=C)[nH]c(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccccc2)c1O 0.571 0.567 0.98 0.499 0.122 0.193 0.015 0.519 0.299 0.519 0.756 Compound_2618 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Cc1ccc(c(c1)N)O 0.737 0.92 0.072 0.886 0.955 0.839 0.966 0.137 0.26 0.121 0.46 Compound_2619 CCCCC12CCC(=O)C(=C2c2c(C1)c1[nH]nnc1cc2)C 0.731 0.91 0.143 0.477 0.693 0.625 0.791 0.798 0.613 0.879 0.864 Compound_2620 CCCCCC=C(c1ccc(cc1)OCCN(CC)CC)c1ccc(cc1)OCCN(CC)CC 0.639 0.526 0.045 0.633 0.485 0.955 0.004 0.508 0.111 0.176 0.229 Compound_2621 c1ccc(cc1)C1=C(c2ccc(cc2)OCCN2CCCC2)c2ccccc2OCC1 0.264 0.72 0.104 0.607 0.837 0.941 0.019 0.235 0.395 0.841 0.536 Compound_2622 Brc1ccc(cc1)C1C(C(=O)c2ccc(cc2)C)C(=O)C(=O)N1c1ccc(cc1)O 0.686 0.582 0.502 0.585 0.449 0.693 0.891 0.521 0.394 0.875 0.472 Compound_2623 COc1cc(ccc1OC)c1nc(C(=O)N)c2c(n1)n(c1cccc(c1)Cl)c(=O)[nH]2 0.629 0.602 0.406 0.491 0.777 0.733 0.529 0.769 0.435 0.006 0.4 Compound_2624 N#CC1C(=N)Oc2c(C1c1cccc(c1)OC(=O)N1CCOCC1)c(CC)[nH]n2 0.686 0.638 0.378 0.603 0.746 0.683 0.174 0.812 0.386 0.216 0.758 Compound_2625 FCSC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Cc1cccc(c1)N 0.55 0.94 0.193 0.891 0.94 0.891 0.969 0.55 0.31 0.349 0.525 Compound_2626 Cc1ccc(cc1)c1n[nH]c(=S)n1NC=C[CH+]c1ccccc1N(=O)=O 0.54 0.595 0.742 0.63 0.464 0.792 0.893 0.789 0.54 0.866 0.884 Compound_2627 O=C1c2ccccc2C(=O)C1c1ccnc2c1cccc2 0.351 0.814 0.923 0.485 0.529 0.826 0.855 0.522 0.83 0.04 0.984 Compound_2628 O=N(=O)c1cc(ccc1N=NCc1c(C)nn(c1Cl)c1ccccc1)S(=O)(=O)Nc1ccccc1C(=O)O 0.449 0.498 0.073 0.411 0.707 0.637 0.919 0.977 0.437 0.326 0.627 Compound_2629 O=S1C2C(=C(C1c1c2c(O)n(c1O)c1ccccc1)c1ccc(cc1)O)c1ccc(cc1)O 0.697 0.814 0.146 0.57 0.904 0.638 0.46 0.172 0.824 0.962 0.602 Compound_2630 CC(CNc1cc(NCC(C)C)nc(n1)Cl)C 0.21 0.265 0.2 0.502 0.18 0.266 0.001 0.085 0.361 0.04 0.017 Compound_2631 CCOC(=O)C1C(=Nc2ccc(cc2)C)SC(=Cc2cn(c3c2cccc3)CC(=O)NCC2CCCO2)C1=O 0.773 0.636 0.145 0.45 0.734 0.616 0.812 0.657 0.393 0.487 0.373 Compound_2632 O1CCN(CC1)CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccccc1 0.324 0.689 0.104 0.594 0.828 0.85 0.057 0.518 0.252 0.294 0.373 Compound_2633 Oc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)Br 0.948 0.673 0.868 0.613 0.628 0.648 0.917 0.65 0.445 0.966 0.773 Compound_2634 CCCCCCCCCCCCCCC=C(c1ccc(cc1)OCCN(CC)CC)c1ccc(cc1)O 0.836 0.533 0.09 0.674 0.818 0.98 0.006 0.856 0.29 0.537 0.385 Compound_2635 CCc1ccc2c(c1)sc(n2)NC(=O)c1ccc2c(c1)nc([nH]c2=O)CN1CCOCC1 0.727 0.564 0.937 0.408 0.458 0.854 0.456 0.773 0.536 0.122 0.163 Compound_2636 Oc1ccc(cc1)n1cnc2c(c1=O)c(O)cc(c2I)O 0.838 0.646 0.794 0.575 0.89 0.632 0.933 0.771 0.419 0.364 0.604 Compound_2637 CC(=O)Oc1cc(OC(=O)C)cc2c1C(=O)OC(C)CCCCCCC2 0.831 0.442 0.682 0.668 0.786 0.367 0.957 0.734 0.598 0.936 0.932 Compound_2638 Cc1cc(ccc1O)C1(c2ccc(c(c2)C)O)c2ccccc2c2c1cccc2 0.885 0.73 0.977 0.78 0.997 1.0 0.159 0.992 0.61 0.991 0.99 Compound_2639 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(cc1)Cc1cccc(c1)N 0.686 0.95 0.131 0.894 0.908 0.914 0.903 0.172 0.224 0.045 0.296 Compound_2640 COc1ccc(c(c1)n1c(O)c2c(c1=O)c([nH]o2)c1ccccc1Cl)OC 0.633 0.768 0.458 0.525 0.725 0.654 0.995 0.413 0.426 0.885 0.663 Compound_2641 Clc1ccc(cc1)C(=O)CSc1[nH]c(=O)c2c(n1)n(nc2)c1ccccc1 0.419 0.569 0.792 0.511 0.717 0.585 0.985 0.51 0.394 0.021 0.517 Compound_2642 CCC1CCNc2c1cc1c(c2)oc(=O)cc1C(F)(F)F 0.785 0.529 0.798 0.486 0.937 0.436 0.85 0.582 0.502 0.345 0.672 Compound_2643 CC(=O)Oc1ccc(cc1)C1Nc2c(ccc(c2C2C1CC=C2)N(=O)=O)C(=O)O 0.673 0.751 0.179 0.59 0.729 0.696 0.759 0.871 0.446 0.525 0.927 Compound_2644 O=C(Nc1ccc(cc1)N1CCCC1)COc1cc(C)cc(c1)C 0.299 0.649 0.757 0.54 0.107 0.695 0.173 0.588 0.511 0.181 0.051 Compound_2645 N#Cc1ccc(cc1)Oc1c(cn(c1C1CC1)CC(=O)NC)C1CC1 0.422 0.674 0.122 0.508 0.512 0.589 0.06 0.385 0.613 0.122 0.67 Compound_2646 CC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)N(=O)=O 0.732 0.732 0.648 0.685 0.366 0.534 0.629 0.903 0.764 0.482 0.825 Compound_2647 Oc1cc(O)c2c(c1)sc(c2)c1ccc(c(c1)C)O 0.826 0.764 0.98 0.793 0.753 0.741 0.582 0.986 0.778 0.922 0.371 Compound_2648 O=c1[nH]c2cc3NC4C(c3cc2c(c1)C(F)(F)F)(C)CCCC4 0.681 0.679 0.344 0.439 0.864 0.674 0.917 0.852 0.49 0.002 0.221 Compound_2649 Oc1ccc2c(c1)sc(c2)c1ccc(c(c1)C(=O)C)O 0.765 0.784 0.986 0.799 0.763 0.792 0.454 0.967 0.663 0.888 0.514 Compound_2650 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccc(c(c1)C)O 0.929 0.794 0.926 0.812 0.901 0.769 0.98 0.967 0.745 0.862 0.783 Compound_2651 N#CC1C(=NC(=C(C1c1ccc(cc1Cl)F)C(=O)OC(C)(C)C)C)C 0.641 0.693 0.11 0.67 0.972 0.55 0.421 0.983 0.579 0.389 0.755 Compound_2652 CCOC(=O)C1=C(CCC)N=C(C(C1c1ccnc2c1cccc2)C#N)C 0.662 0.723 0.46 0.612 0.688 0.377 0.265 0.751 0.487 0.029 0.91 Compound_2653 CCOC(=O)C=Cc1ccc(cc1OC)Oc1c(sc2c1ccc(c2)O)c1ccc(cc1)O 0.866 0.774 0.945 0.835 0.918 0.73 0.992 0.848 0.777 0.819 0.89 Compound_2654 COC(=O)C=Cc1ccc(cc1)Oc1c(sc2c1ccc(c2)O)c1ccccc1 0.934 0.736 0.878 0.848 0.922 0.76 0.995 0.97 0.84 0.796 0.42 Compound_2655 N#Cc1ccc(n1C)c1ccc2c(c1)C(C)(OCC(=O)N2)c1ccco1 0.561 0.595 0.362 0.608 0.61 0.63 0.962 0.88 0.444 0.007 0.811 Compound_2656 OC(=O)c1ccc(cc1)CN(c1ccc(nc1C(F)(F)F)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)C 0.494 0.66 0.519 0.469 0.963 0.732 0.996 0.931 0.258 0.658 0.711 Compound_2657 N#Cc1ccc(n1C)c1ccc2c(c1)C(C)(OCC(=O)N2)c1cscc1 0.722 0.64 0.457 0.643 0.663 0.703 0.971 0.825 0.557 0.017 0.79 Compound_2658 N#Cc1ccc(n1C)c1ccc2c(c1)C(OCC(=O)N2)(c1cccs1)c1cccs1 0.712 0.614 0.879 0.621 0.757 0.662 0.99 0.903 0.672 0.026 0.775 Compound_2659 O=c1oc2cc3NCCC(c3cc2c(c1)C(F)(F)F)C 0.813 0.437 0.88 0.469 0.383 0.244 0.929 0.59 0.452 0.102 0.387 Compound_2660 Cn1c(=O)cc(c2c1cc1NC3C(c1c2)CCCC3)C(F)(F)F 0.729 0.48 0.652 0.44 0.722 0.442 0.836 0.697 0.57 0.002 0.137 Compound_2661 OC(=O)c1ccc(cc1)CN(c1ccc(nc1C(F)(F)F)OCc1c(onc1c1c(Cl)cccc1Cl)C(C)C)C 0.483 0.726 0.604 0.489 0.966 0.769 0.996 0.897 0.194 0.91 0.615 Compound_2662 O=c1[nH]c2cc3NC4C(c3cc2c(c1)C(F)(F)F)(C)CCCC4(C)C 0.533 0.636 0.236 0.498 0.864 0.674 0.917 0.839 0.764 0.257 0.265 Compound_2663 O=c1[nH]c2cc3NC(C(c3cc2c(c1)C(F)(F)F)C)C 0.458 0.684 0.673 0.42 0.591 0.362 0.136 0.766 0.717 0.01 0.513 Compound_2664 CC(=O)Oc1cc2CCCCCCCCCCOC(=O)c2c(c1)OC(=O)C 0.831 0.4 0.913 0.671 0.8 0.369 0.957 0.703 0.755 0.695 0.921 Compound_2665 CCCC1CCNc2c1cc1c(c2)oc(=O)cc1C(F)(F)F 0.792 0.539 0.819 0.467 0.962 0.507 0.873 0.6 0.602 0.171 0.543 Compound_2666 CN1c2cc3n(C)c(=O)cc(c3cc2C2C1CCCC2)C(F)(F)F 0.732 0.576 0.112 0.49 0.879 0.599 0.969 0.707 0.531 0.002 0.234 Compound_2667 O=c1oc2cc3NC(C)(C)C=C(c3cc2c(c1)C(F)(F)F)C 0.769 0.678 0.947 0.446 0.273 0.648 0.97 0.95 0.569 0.981 0.856 Compound_2668 OC1CCC2(C(C1(C)C)(O)CCC1C2(C)c2[nH]c3c(c2C1)cccc3)C 0.491 0.889 0.655 0.59 0.65 0.652 0.088 0.61 0.433 0.717 0.863 Compound_2669 O=c1oc2cc3NCCC(c3cc2c(c1)C(F)(F)F)C(F)(F)F 0.344 0.519 0.947 0.478 0.692 0.337 0.929 0.389 0.701 0.058 0.612 Compound_2670 O=C1CCC2(C(C1(C)C)(O)CCC1C2(C)c2[nH]c3c(c2C1)cccc3)C 0.477 0.875 0.804 0.494 0.663 0.657 0.716 0.725 0.153 0.609 0.824 Compound_2671 CCC1C(CC)CNc2c1cc1c(c2)oc(=O)cc1C(F)(F)F 0.816 0.623 0.152 0.514 0.962 0.507 0.873 0.59 0.511 0.352 0.815 Compound_2672 CCC1Nc2cc3oc(=O)cc(c3cc2CC1C)C(F)(F)F 0.839 0.612 0.873 0.408 0.955 0.543 0.915 0.905 0.746 0.731 0.728 Compound_2673 CN1CCN(CC1)c1nc(NCCc2ccc(cc2)O)nc(n1)NC1CCc2c1cccc2 0.252 0.371 0.49 0.238 0.402 0.513 0.012 0.086 0.615 0.685 0.657 Compound_2674 Oc1ccc(cc1)CCNc1nc(nc(n1)N1CCN(CC1)S(=O)(=O)C(C)C)N(CCCc1ccc(cc1)Cl)C 0.209 0.669 0.254 0.414 0.445 0.858 0.036 0.715 0.432 0.472 0.457 Compound_2675 CNC(=O)OC1CC2(C)C(=CC1O)C=C1C(=C(C)C(=O)N1C)C2C 0.794 0.669 0.004 0.462 0.566 0.899 0.118 0.965 0.418 0.024 0.385 Compound_2676 N#Cc1ccc(cc1Cl)N1N=C2C(C1C1CCCC1)CCc1c2ccc(c1)C(=O)O 0.706 0.542 0.198 0.449 0.969 0.803 0.9 0.952 0.526 0.827 0.854 Compound_2677 CC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cc2OCOc2cc1Br 0.801 0.645 0.986 0.604 0.692 0.636 0.934 0.879 0.518 0.222 0.682 Compound_2678 CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(n1)N1CCc2c(C1)ccc(c2)O 0.14 0.391 0.819 0.22 0.351 0.703 0.051 0.128 0.643 0.648 0.728 Compound_2679 N#Cc1ccc(cc1Cl)N1N=C(CC1C1CCCC1)c1ccc(c(c1)OC)C(=O)O 0.628 0.563 0.201 0.455 0.93 0.781 0.778 0.588 0.495 0.223 0.747 Compound_2680 Oc1ccc(cc1)S(=O)(=O)N(C1CC1)CC(c1ccccc1F)(O)C 0.079 0.525 0.603 0.62 0.371 0.518 0.017 0.491 0.349 0.745 0.5 Compound_2681 CC(c1ccn[nH]1)(CN(S(=O)(=O)c1ccc(cc1)O)C1CC1)O 0.152 0.463 0.163 0.45 0.608 0.649 0.006 0.039 0.357 0.191 0.307 Compound_2682 CCN(C(=O)N1CCN(CC1)c1nc(NCCc2ccc(cc2)O)nc(n1)N(CCCc1ccc(cc1)Cl)C)CC 0.202 0.546 0.248 0.412 0.534 0.89 0.018 0.725 0.437 0.397 0.63 Compound_2683 O=c1oc2cc3NC(C)(C)CCc3cc2c(c1)C(F)(F)F 0.324 0.572 0.717 0.455 0.924 0.583 0.946 0.832 0.536 0.484 0.359 Compound_2684 CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(n1)N1CCCC(C1)c1ccc(cc1)O 0.108 0.302 0.177 0.25 0.472 0.762 0.156 0.08 0.492 0.259 0.571 Compound_2685 CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(n1)NC1CCc2c(C1)cc(cc2)O 0.407 0.391 0.795 0.186 0.334 0.634 0.062 0.132 0.63 0.648 0.712 Compound_2686 CN1CCN(CC1)c1nc(NCCCc2ccccc2)nc(n1)NCCc1cccc(c1)O 0.142 0.342 0.7 0.226 0.195 0.359 0.035 0.147 0.534 0.257 0.537 Compound_2687 O=c1[nH]c2cc3NC4C(c3cc2c(c1)C(F)(F)F)CCCC4 0.7 0.544 0.403 0.437 0.837 0.645 0.831 0.703 0.444 0.008 0.259 Compound_2688 CC1CCC2C(C1)c1cc3c(cc1N2)n(C)c(=O)cc3C(F)(F)F 0.729 0.569 0.484 0.409 0.701 0.578 0.791 0.825 0.544 0.002 0.119 Compound_2689 CC1Nc2c(C1)cc1c(c2)[nH]c(=O)cc1C(F)(F)F 0.613 0.55 0.656 0.333 0.45 0.192 0.506 0.805 0.665 0.004 0.412 Compound_2690 N#Cc1ccc(cc1C(F)(F)F)OC1C(=O)N(CC1(C)C)Cc1ccccc1 0.106 0.602 0.406 0.726 0.665 0.446 0.808 0.897 0.32 0.179 0.5 Compound_2691 COC1C=C2C=C3N(C)C(=O)C(=C3C(C2(CC1OC(=O)N(C)C)C)C)C 0.871 0.793 0.011 0.503 0.579 0.929 0.778 0.948 0.418 0.151 0.441 Compound_2692 N#CC1C(=N)OC2=C(C1c1cocc1)CCCC2=Cc1cocc1 0.786 0.828 0.029 0.562 0.469 0.686 0.993 0.613 0.609 0.536 0.86 Compound_2693 C1CCN(CC1)CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccccc1 0.29 0.659 0.104 0.607 0.75 0.839 0.04 0.248 0.372 0.616 0.372 Compound_2694 Oc1ccc(cc1)N=NC1C(=NN(C1=O)C(=S)N)c1ccc(cc1)N(=O)=O 0.572 0.558 0.952 0.671 0.631 0.792 0.566 0.791 0.401 0.352 0.66 Compound_2695 COc1ccc(cc1)C1=C(c2ccc(cc2)OCCN(C)C)c2ccccc2OCC1 0.317 0.651 0.005 0.771 0.859 0.936 0.005 0.017 0.373 0.033 0.302 Compound_2696 N#CC1C(=N)Oc2c(C1c1cc3cc(CC)ccc3[nH]c1=O)ccc1c2nccc1 0.75 0.801 0.785 0.504 0.529 0.557 0.651 0.807 0.526 0.113 0.732 Compound_2697 COc1ccccc1C1=C(c2ccc(cc2)OCCN(C)C)c2ccccc2OCC1 0.245 0.651 0.011 0.682 0.902 0.847 0.006 0.013 0.314 0.033 0.302 Compound_2698 Oc1ccc(cc1)C(c1ccc(cc1)O)(c1ccccc1)C 0.959 0.758 0.737 0.633 0.998 1.0 0.95 0.792 0.62 0.862 0.935 Compound_2699 COc1cc(ccc1OC)C1CC(=NN1S(=O)(=O)C)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Cl 0.786 0.65 0.859 0.549 0.726 0.856 0.748 0.373 0.405 0.742 0.431 Compound_2700 Fc1ccc(cc1)Nc1nc(CSc2nnnn2c2ccccc2)cc(=O)[nH]1 0.531 0.437 0.333 0.392 0.647 0.81 0.192 0.393 0.669 0.003 0.398 Compound_2701 Cc1ccc(cc1)CN(C(=O)N1CCOCC1)Cc1cc2cc(C)ccc2[nH]c1=O 0.551 0.6 0.658 0.46 0.414 0.646 0.323 0.623 0.44 0.049 0.25 Compound_2702 Oc1ccc(cc1)NCc1ccccc1OCc1ccccc1F 0.612 0.627 0.933 0.628 0.97 0.956 0.071 0.617 0.823 0.545 0.957 Compound_2703 COC(=O)c1ccc(o1)CSc1[nH]c(=O)c2c(n1)n(nc2)c1ccc(cc1)F 0.498 0.603 0.29 0.461 0.465 0.569 0.685 0.407 0.5 0.027 0.552 Compound_2704 CC(=CCc1c2OC(Cc2c2c(c1O)c(=O)c(co2)c1ccc(c(c1)O)O)C(O)(C)C)C 0.8 0.847 0.807 0.738 0.945 0.743 0.367 0.942 0.372 0.536 0.916 Compound_2705 O=c1[nH]c2c(C)cccc2cc1C(c1nnnn1C(C)(C)C)N(Cc1ccco1)CC1CCCO1 0.701 0.689 0.008 0.208 0.282 0.653 0.007 0.412 0.3 0.952 0.201 Compound_2706 COc1ccc(cc1)C(=O)Nc1nc2cc(OC)c(cc2c(=O)[nH]1)OC 0.578 0.648 0.806 0.598 0.529 0.707 0.816 0.157 0.546 0.061 0.438 Compound_2707 O=c1cc(COC(=O)c2n[nH]c3c2cccc3)c2c(o1)cc(c(c2)C)C 0.693 0.69 0.995 0.546 0.874 0.74 0.985 0.737 0.8 0.213 0.912 Compound_2708 CN(Cc1nc2ccccc2c(=O)[nH]1)CC(=O)NC(=O)NCc1ccco1 0.235 0.559 0.402 0.321 0.103 0.527 0.003 0.304 0.356 0.045 0.455 Compound_2709 CCOC(=O)Cc1cc(=O)n2c(n1)cc([nH]2)c1ccc(cc1)C 0.532 0.719 0.565 0.584 0.495 0.785 0.661 0.826 0.354 0.003 0.314 Compound_2710 CCN(CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccccc1)CC 0.281 0.647 0.095 0.631 0.846 0.931 0.005 0.188 0.09 0.189 0.633 Compound_2711 CCSc1[nH]c(=O)c2c(n1)n(nc2)c1ccc(cc1)C 0.339 0.682 0.704 0.469 0.486 0.524 0.22 0.091 0.364 0.026 0.381 Compound_2712 O=C(c1ccccc1)Nc1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCOCC1 0.518 0.516 0.213 0.619 0.395 0.805 0.985 0.466 0.387 0.211 0.221 Compound_2713 Clc1ccc(c(c1)Cl)c1sc2n(n1)c(nn2)c1n[nH]c(c1)C 0.496 0.632 0.703 0.624 0.674 0.653 0.773 0.198 0.494 0.255 0.177 Compound_2714 CN(CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccc(cc1)C)C 0.29 0.641 0.005 0.762 0.851 0.956 0.017 0.172 0.348 0.042 0.312 Compound_2715 NC(=NN=CC1=C(Cl)c2ccccc2CCC1)N 0.39 0.566 0.723 0.497 0.125 0.167 0.055 0.841 0.571 0.077 0.366 Compound_2716 CCOc1ccccc1C1C(C#N)C(=Nc2c1c(no2)c1ccccc1)N 0.537 0.752 0.65 0.639 0.907 0.809 0.992 0.869 0.403 0.057 0.779 Compound_2717 Oc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.842 0.826 0.992 0.896 0.957 0.812 0.998 0.996 0.904 0.393 0.981 Compound_2718 CC(=CCc1c(O)c(CC(C(=C)C)O)c2c(c1O)c(=O)c(co2)c1ccc(c(c1)O)O)C 0.856 0.742 0.419 0.708 0.889 0.884 0.037 0.98 0.206 0.128 0.713 Compound_2719 CN(CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1ccc(cc1)Cl)C 0.309 0.591 0.066 0.683 0.927 0.941 0.002 0.516 0.218 0.08 0.676 Compound_2720 O=N(=O)c1ccccc1NC(=O)C1C(=O)CC[n+]2c1[nH]c1c2cccc1 0.456 0.565 0.829 0.463 0.381 0.437 0.03 0.963 0.407 0.128 0.451 Compound_2721 Oc1ccc(cc1)C=C1C(=O)c2c(S1(=O)=O)cccc2 0.713 0.74 0.835 0.647 0.729 0.902 0.644 0.903 0.416 0.855 0.343 Compound_2722 OC(=O)CCC(c1ccc(cc1)O)(c1ccc(cc1)O)C 0.87 0.694 0.346 0.268 0.961 0.958 0.971 0.067 0.194 0.192 0.035 Compound_2723 N#CC1C(=N)Oc2c(C1c1cc3cc(C)ccc3[nH]c1=O)ccc1c2nccc1 0.661 0.837 0.956 0.496 0.594 0.595 0.994 0.862 0.609 0.167 0.649 Compound_2724 COC(=O)c1c(=C)[nH]c(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccc(c(c2)C)C)c1O 0.536 0.597 0.964 0.462 0.144 0.272 0.32 0.134 0.432 0.332 0.784 Compound_2725 Cc1ccc(cc1)N=Cc1c2ccccc2c(=O)n(c1O)c1ccc2c(c1)OCO2 0.558 0.819 0.84 0.478 0.797 0.674 0.982 0.621 0.557 0.168 0.443 Compound_2726 COc1ccc(cc1)C1CC(=Nc2n1nc(n2)NC(=O)C)c1ccc(cc1)Cl 0.633 0.74 0.638 0.542 0.273 0.874 0.287 0.062 0.429 0.038 0.482 Compound_2727 COc1cc2cc(c(=O)[nH]c2cc1OC)C(N1CCc2c1cccc2)c1nnnn1C1CCCC1 0.719 0.787 0.181 0.349 0.706 0.684 0.062 0.347 0.694 0.002 0.051 Compound_2728 COc1ccc(cc1NC(=O)c1[nH]nc(c1)c1ccc(cc1O)C)OC 0.635 0.72 0.976 0.726 0.821 0.665 0.801 0.684 0.335 0.916 0.866 Compound_2729 CCOC(=O)NC1[O+]NN(C1)N1CCOCC1 0.287 0.379 0.132 0.298 0.085 0.137 0.003 0.075 0.274 0.551 0.457 Compound_2730 CCOc1ccc(cc1)Cc1sc(nc1O)Nc1ccccn1 0.483 0.579 0.511 0.533 0.5 0.635 0.207 0.317 0.37 0.043 0.377 Compound_2731 C#CC1(O)CCC2C1(C)CC(O)C1C2CCc2c1ccc(c2)O 0.913 0.973 0.011 0.491 0.962 0.939 0.034 0.042 0.133 0.997 0.861 Compound_2732 Cc1ccc2c(c1)cc(c(=O)[nH]2)c1nc2n(c1NCc1ccco1)cccc2 0.615 0.725 0.507 0.439 0.539 0.639 0.935 0.405 0.335 0.017 0.356 Compound_2733 CCc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1ccco1)Cc1ccc2c(c1)OCO2 0.689 0.744 0.951 0.453 0.178 0.645 0.519 0.937 0.363 0.274 0.444 Compound_2734 N#CC1C(=N)Oc2c(C1c1cc(OC)c3c(c1)OCO3)c(=O)oc(c2)C 0.781 0.791 0.649 0.612 0.626 0.592 0.802 0.327 0.646 0.027 0.684 Compound_2735 N#CC(c1nc2c([nH]1)cccc2)C(=O)Nc1ccc(cc1)Cl 0.289 0.703 1.001 0.675 0.573 0.76 0.399 0.922 0.42 0.897 0.899 Compound_2736 CCOC(=O)C1C(=N)Oc2c(C1c1ccc(cc1F)F)ccc(c2)O 0.635 0.55 0.699 0.728 0.978 0.805 0.989 0.766 0.49 0.391 0.663 Compound_2737 Cc1ccc(n1c1sccc1c1cc2n([nH]1)c(=O)c(c(n2)C)Cl)C 0.638 0.6 0.206 0.459 0.606 0.671 0.961 0.309 0.862 0.412 0.079 Compound_2738 Brc1cncc(c1)C(=O)NN=Cc1cccc(c1)Oc1ccc(cc1N(=O)=O)N(=O)=O 0.547 0.675 0.957 0.529 0.665 0.679 0.882 0.829 0.408 0.843 0.784 Compound_2739 CC(CNc1cc(CC(C)C)nc(n1)NCC(C)C)C 0.256 0.256 0.217 0.344 0.222 0.689 0.004 0.322 0.149 0.041 0.153 Compound_2740 CC(=CCc1c(O)c(CC(C(=C)C)O)c(c2c1occ(c2=O)c1ccc(c(c1)O)O)O)C 0.835 0.817 0.419 0.708 0.912 0.902 0.158 0.98 0.35 0.128 0.406 Compound_2741 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(cc1)CSc1cccc(c1)N 0.555 0.92 0.146 0.878 0.81 0.761 0.898 0.218 0.207 0.103 0.511 Compound_2742 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(c(c1)O)Oc1ccc(cc1)N 0.764 0.93 0.035 0.876 0.974 0.816 0.826 0.126 0.335 0.108 0.559 Compound_2743 OCC(=O)C12OC(OC2CC2C1(C)CC(O)C1C2CCC2=CC(=O)C=CC12C)c1ccc(c(c1)O)Cc1cccc(c1)N 0.801 0.94 0.191 0.805 0.961 0.923 0.91 0.892 0.204 0.011 0.725 Compound_2744 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(nc1)NC(c1ccc(cc1)N)C 0.621 0.89 0.094 0.873 0.601 0.772 0.772 0.128 0.244 0.532 0.332 Compound_2745 CS(=O)(=O)c1ccc(cc1)c1cnc(n2c1nnc2)NCc1ccco1 0.151 0.582 0.379 0.628 0.588 0.652 0.952 0.537 0.381 0.095 0.519 Compound_2746 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Cc1ccc(c(c1)OC)N 0.661 0.94 0.241 0.857 0.946 0.844 0.984 0.261 0.285 0.375 0.725 Compound_2747 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)C(c1ccc(cc1)N)C 0.699 0.95 0.017 0.862 0.951 0.925 0.982 0.051 0.259 0.144 0.493 Compound_2748 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(nc1)NCc1ccc(cc1)N 0.578 0.89 0.094 0.873 0.603 0.771 0.582 0.149 0.236 0.15 0.183 Compound_2749 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)Cc1ccc(c(c1)N)O 0.775 0.93 0.219 0.832 0.942 0.848 0.932 0.848 0.242 0.046 0.714 Compound_2750 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)Cc1cccc(c1)N 0.707 0.96 0.11 0.819 0.9 0.917 0.903 0.705 0.207 0.02 0.605 Compound_2751 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)C(c1cccc(c1)N)C 0.684 0.95 0.021 0.862 0.931 0.909 0.961 0.055 0.224 0.144 0.493 Compound_2752 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Sc1ccc(cc1)N 0.467 0.91 0.04 0.879 0.903 0.748 0.956 0.064 0.207 0.062 0.579 Compound_2753 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(nc1)NC1(CC1)c1ccc(cc1)N 0.653 0.91 0.094 0.873 0.661 0.746 0.906 0.152 0.307 0.082 0.235 Compound_2754 OCC(=O)C12OC(OC2CC2C1(C)CC(O)C1(C2CC(C2=CC(=O)C=CC12C)F)F)c1ccc(c(c1)O)Cc1cccc(c1)N 0.754 0.93 0.072 0.865 0.973 0.914 0.954 0.207 0.226 0.031 0.459 Compound_2755 O=C1C=CC2(C(=C1)C(F)CC1C2(F)C(O)CC2(C1CC1C2(OC(O1)c1ccc(cc1)Cc1cccc(c1)N)C(=O)O)C)C 0.614 0.95 0.024 0.726 0.935 0.9 0.974 0.07 0.242 0.498 0.362 Compound_2756 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)CSc1cccc(c1)N 0.548 0.9 0.039 0.861 0.83 0.757 0.958 0.104 0.21 0.112 0.542 Compound_2757 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)(C)c1ccc(cc1)Sc1ccc(cc1)N 0.487 0.91 0.056 0.889 0.921 0.756 0.956 0.054 0.262 0.178 0.691 Compound_2758 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)CSc1ccc(c(c1)Cl)N 0.611 0.9 0.035 0.851 0.789 0.67 0.889 0.102 0.247 0.19 0.635 Compound_2759 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)S(=O)(=O)c1ccc(cc1)N 0.477 0.93 0.051 0.838 0.828 0.73 0.764 0.621 0.228 0.026 0.318 Compound_2760 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)(C)c1ccc(cc1)Sc1ccc(cc1)N 0.525 0.93 0.196 0.817 0.905 0.76 0.833 0.602 0.244 0.109 0.883 Compound_2761 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(cc1)Sc1cccc(c1)N 0.532 0.93 0.161 0.884 0.774 0.724 0.833 0.192 0.186 0.057 0.551 Compound_2762 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)Sc1ccc(c(c1)N)Cl 0.587 0.93 0.514 0.82 0.732 0.678 0.719 0.726 0.218 0.094 0.726 Compound_2763 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CCC1=CC(=O)C=CC21C)F)c1ccc(cc1)Sc1ccc(c(c1)N)Cl 0.571 0.93 0.485 0.843 0.735 0.678 0.719 0.196 0.235 0.094 0.637 Compound_2764 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)CSc1ccc(cc1)N 0.568 0.9 0.039 0.872 0.924 0.789 0.958 0.081 0.225 0.112 0.542 Compound_2765 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Cc1ccc(c(c1)N)Cl 0.713 0.95 0.173 0.867 0.92 0.802 0.885 0.099 0.276 0.108 0.462 Compound_2766 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Cc1ccc(cc1)N 0.682 0.95 0.028 0.888 0.951 0.925 0.982 0.077 0.352 0.049 0.341 Compound_2767 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(c(c1)O)Cc1ccc(cc1)N 0.776 0.93 0.058 0.875 0.982 0.927 0.979 0.197 0.264 0.031 0.459 Compound_2768 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Oc1ccc(cc1)N 0.727 0.94 0.04 0.879 0.975 0.907 0.96 0.064 0.368 0.093 0.493 Compound_2769 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2(C1CC(C1=CC(=O)C=CC21C)F)F)c1ccc(cc1)Oc1cccc(c1)N 0.689 0.93 0.044 0.869 0.969 0.816 0.979 0.09 0.282 0.107 0.543 Compound_2770 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)Sc1cccc(c1)N 0.549 0.93 0.136 0.838 0.767 0.724 0.833 0.755 0.166 0.025 0.782 Compound_2771 OCC(=O)C12OC(OC1CC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C)c1ccc(cc1)CSc1cccc(c1)N 0.576 0.92 0.123 0.885 0.804 0.762 0.898 0.773 0.188 0.047 0.742 Compound_2772 COc1ccc(cc1)c1nnc(o1)SCC(=O)C(C(=N)C)C#N 0.472 0.56 0.956 0.746 0.566 0.644 0.611 0.786 0.442 0.026 0.85 Compound_2773 O=C(c1ccc(cc1)O)c1ccc(cc1)O 0.955 0.794 0.792 0.782 0.905 0.996 0.993 0.633 0.938 0.265 0.881 Compound_2774 Cc1ccc(cc1)C(=O)Oc1cccc2c1cccc2O 0.74 0.715 0.767 0.709 0.93 0.772 0.973 0.467 0.546 0.726 0.537 Compound_2775 CN(CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1cccc(c1)C)C 0.367 0.641 0.016 0.762 0.828 0.951 0.013 0.17 0.48 0.042 0.312 Compound_2776 CCCCCCC1=CC2CC(=c3[nH]nc(o3)C3CCCCC3)C(=O)OC2=CC1=O 0.609 0.594 0.938 0.584 0.527 0.587 0.939 0.954 0.476 0.123 0.49 Compound_2777 Fc1ccc(cc1)Oc1c(=O)c2ccc(c(c2oc1C(F)(F)F)O)O 0.774 0.702 0.843 0.645 0.918 0.244 0.983 0.989 0.492 0.066 0.935 Compound_2778 CC(=C(c1ccccc1)Cl)C=NN=C(N)N 0.31 0.491 0.151 0.477 0.058 0.251 0.055 0.845 0.583 0.073 0.187 Compound_2779 N#CC(C(=O)CSc1nnc(o1)COc1ccccc1Cl)C(=N)C 0.527 0.656 0.837 0.682 0.589 0.603 0.505 0.92 0.427 0.366 0.835 Compound_2780 COC(=O)c1ccc(o1)CSc1[nH]c(=O)c2c(n1)n(nc2)c1ccc(c(c1)C)C 0.524 0.718 0.546 0.449 0.461 0.592 0.951 0.169 0.459 0.094 0.615 Compound_2781 CCC1CCC2C1(C)CCC1C2CCc2c1ccc(c2)O 0.966 0.85 0.068 0.391 0.984 0.995 0.036 0.484 0.25 0.999 0.996 Compound_2782 O=C(Nc1sc2c(c1C(=O)Nc1ccccc1)CCCC2)CSc1nnc([nH]1)c1ccco1 0.623 0.586 0.832 0.675 0.668 0.653 0.961 0.518 0.444 0.098 0.509 Compound_2783 CCOC(=O)c1c(=C)sc(=CN(C)C)c1O 0.617 0.576 0.797 0.406 0.336 0.227 0.199 0.34 0.312 0.422 0.77 Compound_2784 CCOC(=O)c1c(=C)[nH]c(=Cc2ccc(o2)CNC(=O)C(=O)Nc2ccc(c(c2)C)C)c1O 0.581 0.607 0.995 0.496 0.157 0.288 0.291 0.166 0.408 0.535 0.818 Compound_2785 Clc1ccc(c(c1)NC=C1C(=O)CC(CC1=O)c1ccco1)O 0.446 0.642 0.837 0.426 0.346 0.581 0.44 0.939 0.511 0.839 0.984 Compound_2786 N#CC(C(=O)CSc1nnc(o1)c1ccc(cc1)OC(F)F)C(=N)C 0.495 0.55 0.956 0.76 0.68 0.648 0.444 0.886 0.418 0.025 0.863 Compound_2787 O=C(Nc1nccs1)CSc1nnc([nH]1)c1ccc(cc1)S(=O)(=O)N1CCCCC1 0.488 0.506 0.088 0.452 0.524 0.665 0.586 0.172 0.342 0.023 0.141 Compound_2788 Nc1nc(nn1c1ccccc1)n1c(O)c2c(c1O)CC=CC2 0.424 0.621 0.819 0.521 0.645 0.633 0.088 0.549 0.833 0.334 0.682 Compound_2789 CC1CCCN(C1)C(=O)COC(=O)c1n[nH]c2c1cccc2 0.297 0.776 0.879 0.519 0.5 0.664 0.168 0.17 0.376 0.139 0.297 Compound_2790 COc1ccc(cc1)Cc1nc2c([nH]1)cc(cc2)S(=O)(=O)N1CCOCC1 0.245 0.57 0.865 0.529 0.53 0.663 0.261 0.184 0.357 0.253 0.156 Compound_2791 COc1ccc(cc1)C=CC(=O)C1=C(O)N(C)C2(CC1c1ccccc1O2)C 0.691 0.722 0.22 0.455 0.304 0.914 0.662 0.892 0.223 0.61 0.65 Compound_2792 O=C(c1cc(ccc1C)S(=O)(=O)N1CCCCC1)Nc1nnc[nH]1 0.387 0.556 0.159 0.335 0.267 0.663 0.005 0.035 0.385 0.028 0.331 Compound_2793 C1CCC(CC1)c1nn2c(s1)nnc2c1n[nH]c2c1CCC2 0.597 0.473 0.189 0.451 0.682 0.652 0.762 0.309 0.427 0.415 0.126 Compound_2794 N#CC(C(=O)CSc1nnc(n1N)Cc1ccccc1F)C(=N)C 0.632 0.518 0.862 0.599 0.295 0.585 0.319 0.77 0.475 0.006 0.708 Compound_2795 Fc1cc(ccc1O)C(C(C(=O)Nc1scnn1)(C)C)c1ccccc1 0.397 0.646 0.289 0.513 0.343 0.873 0.942 0.14 0.415 0.291 0.513 Compound_2796 Fc1cc(ccc1O)C(C(C(=O)Nc1nccs1)(C)C)c1ccccc1 0.39 0.639 0.171 0.488 0.34 0.869 0.327 0.105 0.434 0.276 0.655 Compound_2797 Brc1cc(ccc1O)C(C(C(=O)Nc1nccs1)(C)C)c1ccccc1 0.435 0.676 0.171 0.488 0.696 0.672 0.258 0.105 0.428 0.537 0.609 Compound_2798 COC(=O)C(c1ncc(cc1Cl)C(F)(F)F)C=Nc1ccc(c2c1cccc2)Cl 0.528 0.602 0.937 0.639 0.818 0.511 0.998 0.922 0.61 0.56 0.812 Compound_2799 Brc1cnc2c(c1)[nH]c(n2)COc1cc(C)cc(c1)C 0.317 0.603 0.979 0.561 0.535 0.658 0.034 0.196 0.479 0.201 0.666 Compound_2800 Fc1ccc(cc1)Nc1nc(N=NCc2ccc(c(c2)N(=O)=O)Cl)nc(n1)N(C)C 0.899 0.585 0.813 0.573 0.783 0.797 0.911 0.737 0.496 0.556 0.818 Compound_2801 Oc1ccc2c(c1)oc(=O)cc2CSc1cccc(n1)C 0.729 0.625 0.932 0.486 0.924 0.915 0.408 0.519 0.652 0.182 0.909 Compound_2802 CSc1ccc(cc1)C1C(C#N)C(=N)Oc2c1ccc(=O)c1c2c(C)oc1C 0.748 0.819 0.819 0.57 0.556 0.61 0.988 0.557 0.37 0.509 0.877 Compound_2803 OCCN=C(C(F)(F)F)CC(=O)c1ccc(cc1)Cl 0.528 0.349 0.673 0.677 0.584 0.813 0.974 0.374 0.266 0.062 0.372 Compound_2804 CCCCc1c(O)n(n(c1=O)c1ccccc1)c1ccccc1 0.591 0.59 0.036 0.375 0.455 0.702 0.718 0.091 0.426 0.051 0.23 Compound_2805 O=C(c1ccco1)Oc1ccc(cc1)n1c(O)ccc1O 0.423 0.47 0.045 0.552 0.698 0.613 0.944 0.243 0.518 0.074 0.557 Compound_2806 CCCCSc1nnc2c(n1)[nH]c1c2cccc1 0.463 0.637 0.883 0.521 0.6 0.742 0.669 0.377 0.777 0.316 0.619 Compound_2807 Oc1ccc(cc1)C1C2C3CCC(C2Sc2c1sc(=O)[nH]2)C3 0.612 0.722 0.053 0.436 0.878 0.671 0.497 0.081 0.297 0.185 0.361 Compound_2808 O=c1c2ccccc2nc2n1CCCCN2 0.343 0.396 0.926 0.392 0.334 0.138 0.009 0.154 0.709 0.002 0.061 Compound_2809 O=c1[nH]c2cc3OCCOc3cc2cc1CN(Cc1nnnn1Cc1ccco1)Cc1cccs1 0.696 0.607 0.4 0.412 0.671 0.658 0.758 0.429 0.415 0.352 0.106 Compound_2810 COc1cccc(c1)C1=C(c2ccc(cc2)OCCN(C)C)c2ccccc2OCC1 0.335 0.651 0.005 0.771 0.865 0.88 0.004 0.027 0.157 0.033 0.302 Compound_2811 Oc1ccc(cc1)Oc1ccc(cc1)O 0.953 0.815 0.896 0.681 0.905 0.898 0.991 0.827 0.98 0.283 0.951 Compound_2812 CN(CCOc1ccc(cc1)C1=C(CCOc2c1cccc2)c1cccc(c1)N(=O)=O)C 0.488 0.744 0.008 0.842 0.912 0.942 0.083 0.462 0.413 0.79 0.73 Compound_2813 Oc1cc(O)c2c(c1)ncn(c2=O)c1ccc(=O)[nH]c1 0.575 0.721 0.31 0.455 0.444 0.671 0.822 0.282 0.673 0.088 0.415 Compound_2814 CCC1CCC2C1(C)CC(O)C1C2CCc2c1ccc(c2)O 0.849 0.9 0.025 0.463 0.975 0.993 0.018 0.085 0.071 1.0 0.991 Compound_2815 N#Cc1ccc(cc1)C1=C(c2ccc(cc2)OCCN(C)C)c2ccccc2OCC1 0.412 0.624 0.006 0.749 0.933 0.726 0.041 0.16 0.485 0.032 0.522 Compound_2816 Fc1cc(ccc1C(=O)N(C)C)c1ccc2c(n1)Oc1c(C2C(C(=O)Nc2scnn2)(C)C)cccc1 0.653 0.799 0.833 0.643 0.446 0.823 0.998 0.713 0.425 0.794 0.489 Compound_2817 CCN(C(=O)c1ccc(cc1F)c1ccc2c(n1)Oc1c(C2C(C(=O)Nc2nncs2)(C)C)cccc1)C 0.656 0.725 0.376 0.617 0.417 0.825 0.999 0.791 0.392 0.863 0.46 Compound_2818 O=C(c1ccc(cc1)c1ccc2c(n1)Oc1c(C2C(C(=O)Nc2scnn2)(C)C)cccc1)N(C)C 0.62 0.808 0.753 0.672 0.375 0.838 0.998 0.78 0.417 0.707 0.451 Compound_2819 CCNc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.805 0.68 0.989 0.813 0.837 0.464 0.498 0.767 0.603 0.199 0.952 Compound_2820 CCCCNc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.774 0.653 0.917 0.731 0.837 0.464 0.498 0.777 0.571 0.096 0.661 Compound_2821 Nc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.809 0.755 0.998 0.93 0.843 0.635 0.998 0.962 0.925 0.655 0.986 Compound_2822 CN(c1ccc(cc1)c1cc(=O)c2c(o1)cccc2N)C 0.819 0.783 0.999 0.799 0.857 0.586 0.961 0.987 0.922 0.355 0.881 Compound_2823 Nc1cccc2c1c(=O)cc(o2)c1ccc(cc1)NCc1ccccc1 0.782 0.672 0.998 0.871 0.95 0.535 0.857 0.96 0.855 0.124 0.961 Compound_2824 N#Cc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.798 0.759 0.991 0.887 0.946 0.575 0.998 0.947 0.741 0.723 0.976 Compound_2825 Nc1cccc2c1c(=O)cc(o2)c1ccccc1 0.787 0.814 0.998 0.925 0.342 0.932 0.966 0.961 0.885 0.743 0.964 Compound_2826 COc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.796 0.858 0.997 0.891 0.854 0.815 0.999 0.988 0.865 0.226 0.956 Compound_2827 Brc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.783 0.759 0.993 0.784 0.408 0.646 0.997 0.704 0.587 0.921 0.936 Compound_2828 CNc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.814 0.767 0.998 0.825 0.835 0.508 0.841 0.982 0.687 0.556 0.972 Compound_2829 CC(=O)Nc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.821 0.812 0.98 0.826 0.776 0.537 0.983 0.945 0.73 0.314 0.829 Compound_2830 OC1CCC2(C(=CCC3C2CCC2(C3CCC2=Cc2ccccn2)C)C1)C 0.835 0.93 0.097 0.729 0.375 0.891 0.011 0.97 0.308 0.678 0.719 Compound_2831 Brc1ccc(c(c1)C=NNC(=O)c1cc2ccccc2cc1O)O 0.774 0.726 0.992 0.573 0.638 0.676 0.707 0.975 0.415 0.982 0.732 Compound_2832 CCCNc1ccc(cc1)c1cc(=O)c2c(o1)cccc2N 0.777 0.622 0.917 0.773 0.837 0.464 0.498 0.766 0.533 0.067 0.735 Compound_2833 Oc1ccc(cc1)C1=C(Oc2c(S1=O)cc(cc2)O)c1ccc(cc1)OCCN1CCCCC1 0.601 0.738 0.298 0.596 0.787 0.65 0.045 0.83 0.196 0.816 0.366 Compound_2834 OC1CCC2(C(=C1)CCC1C2CCC2(C1CCC2=Cc1ccccn1)C)C 0.797 0.96 0.253 0.66 0.454 0.895 0.009 0.957 0.333 0.651 0.628 Compound_2835 NNC(=O)c1cc2nc([nH]c2cc1N(=O)=O)C 0.403 0.411 0.999 0.423 0.53 0.657 0.081 0.981 0.432 0.18 0.558 Compound_2836 Cc1[nH]c2c(n1)cc(c(c2)N(=O)=O)C(=O)O 0.471 0.415 0.979 0.389 0.487 0.656 0.214 0.947 0.417 0.516 0.894 Compound_2837 COc1cc(C=NNC(=O)c2oc3c(c2)c2ccccc2cc3)cc(c1O)OC 0.393 0.793 0.99 0.521 0.174 0.624 0.97 0.76 0.423 0.547 0.513 Compound_2838 O=C1CCC2(C(=C1)C(=O)CC1C2CCC2(C1CCC2=Cc1ccccn1)C)C 0.82 0.97 0.136 0.769 0.416 0.877 0.009 0.956 0.363 0.723 0.576 Compound_2839 CC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CC(C2=Cc2ccccn2)O)C)C1)C 0.786 0.98 0.029 0.708 0.716 0.919 0.031 0.982 0.581 0.945 0.081 Compound_2840 N#CCSc1nnc(o1)c1ccc2c(c1)nc([nH]2)C 0.397 0.556 0.995 0.591 0.566 0.658 0.633 0.476 0.43 0.096 0.823 Compound_2841 O=C1CCC2(C(=C1)CCC1C2CCC2(C1CCC2=Cc1ccccn1)C)C 0.864 0.94 0.22 0.758 0.31 0.846 0.009 0.745 0.321 0.813 0.601 Compound_2842 CCOC(=O)c1cc2nc([nH]c2cc1N(=O)=O)C 0.395 0.434 1.001 0.557 0.491 0.659 0.287 0.585 0.402 0.319 0.899 Compound_2843 O=N(=O)c1cc2[nH]c(nc2cc1c1n[nH]c(=S)o1)C 0.475 0.468 0.978 0.428 0.541 0.665 0.446 0.894 0.417 0.569 0.765 Compound_2844 O=C1CCC2(C(=C1O)C=CC1C2CCC2(C1CCC2=Cc1ccccn1)C)C 0.863 0.97 0.086 0.673 0.303 0.851 0.017 0.96 0.168 0.261 0.2 Compound_2845 CC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2=Cc2ccccn2)C)C1)C 0.831 0.99 0.118 0.709 0.606 0.892 0.067 0.968 0.656 0.992 0.21 Compound_2846 CC(=O)OC1CCC2(C(=C(CC3C2CCC2(C3CCC2=Cc2ccccn2)C)N(=O)=O)C1)C 0.73 0.903 0.024 0.592 0.705 0.903 0.106 0.697 0.625 0.851 0.762 Compound_2847 Cc1[nH]c2c(n1)cc(cc2)c1nnc(o1)SS(=O)(=O)C 0.243 0.381 1.0 0.579 0.531 0.658 0.48 0.838 0.411 0.153 0.494 Compound_2848 C#CC1(O)CCC2C1(C)CCC1C2C(O)Cc2c1ccc(c2)O 0.898 0.973 0.006 0.444 0.969 0.943 0.052 0.136 0.105 0.997 0.861 Compound_2849 Oc1ccc(cc1)C(c1ccccc1)(C)C 0.955 0.558 0.749 0.64 0.92 0.981 0.972 0.94 0.665 0.79 0.765 Compound_2850 OC1=CC2C(C=C1)C(CC12CC(C2C1C=C(O)C=C2)(C)C)(C)C 0.948 0.678 0.275 0.53 0.961 0.868 0.236 0.897 0.81 0.991 0.873 Compound_2851 CC(c1cc(O)c(cc1O)C(C)(C)C)(C)C 0.889 0.083 0.853 0.598 0.613 0.441 0.057 0.995 0.789 0.986 0.663 Compound_2852 Oc1ccc(cc1)C1(c2ccc(cc2)O)c2ccccc2C(=O)N1c1ccccc1 0.932 0.753 0.47 0.481 0.976 0.986 0.929 0.179 0.413 0.184 0.94 Compound_2853 CC(c1cc(C)c(c(c1)C)O)(c1cc(C)c(c(c1)C)O)C 0.837 0.472 0.443 0.581 0.822 0.991 0.42 0.928 0.866 0.997 0.945 Compound_2854 CCC(=C(c1ccccc1)c1ccc(cc1)OCN(C)C)Cc1ccccc1 0.528 0.558 0.019 0.283 0.747 0.99 0.084 0.863 0.461 0.58 0.387 Compound_2855 CC(CCc1cc(OCC(C)C)nc(n1)OCC(C)C)C 0.708 0.353 0.894 0.529 0.457 0.589 0.106 0.267 0.176 0.166 0.122 Compound_2856 c1ccc(cc1)CNc1nc(NCc2cccc3c2cccc3)nc(c1)C=Cc1ccccc1 0.646 0.654 0.94 0.641 0.892 0.932 0.573 0.805 0.38 0.372 0.828 Compound_2857 c1ccc(cc1)C=Cc1cc(NCc2cccc3c2cccc3)nc(n1)NCc1cccc2c1cccc2 0.646 0.654 0.94 0.646 0.926 0.92 0.573 0.794 0.366 0.372 0.828 Compound_2858 CC(CCc1cc(SCC(C)C)nc(n1)SCC(C)C)C 0.6 0.343 0.894 0.529 0.508 0.72 0.542 0.267 0.138 0.082 0.282 Compound_2859 c1ccc(cc1)CCc1cc(CCc2ccccc2)nc(n1)NCc1ccccc1 0.376 0.485 0.696 0.512 0.913 0.957 0.59 0.439 0.227 0.041 0.327 Compound_2860 CC(CNc1nc(NCc2cccc3c2cccc3)cc(n1)CCc1ccccc1)C 0.389 0.472 0.399 0.46 0.8 0.925 0.519 0.493 0.338 0.024 0.472 Compound_2861 CC(CNc1nc(CCc2cccc3c2cccc3)cc(n1)NCc1ccccc1)C 0.391 0.472 0.387 0.432 0.8 0.925 0.519 0.373 0.356 0.024 0.472 Compound_2862 CC(CNc1cc(CCc2cccc3c2cccc3)nc(n1)NCc1ccccc1)C 0.323 0.472 0.17 0.449 0.8 0.925 0.519 0.498 0.356 0.024 0.472 Compound_2863 c1ccc(cc1)CCc1cc(NCc2ccccc2)nc(n1)NCc1cccc2c1cccc2 0.397 0.543 0.716 0.56 0.892 0.932 0.573 0.683 0.366 0.161 0.721 Compound_2864 CC(CNc1cc(CCc2cccc3c2cccc3)nc(n1)NCc1cccc2c1cccc2)C 0.322 0.472 0.17 0.461 0.876 0.949 0.677 0.481 0.335 0.024 0.472 Compound_2865 CC(CNc1ncnc(c1)NCC(C)C)C 0.149 0.251 0.398 0.463 0.077 0.212 0.0 0.101 0.61 0.04 0.074 Compound_2866 CC(CCc1nc(NCc2cccc3c2cccc3)nc(c1)N(C(=O)OC(C)(C)C)Cc1ccccc1)C 0.583 0.622 0.58 0.585 0.801 0.922 0.87 0.729 0.362 0.235 0.367 Compound_2867 CC(CNc1cc(SCC(C)C)nc(n1)NCC(C)C)C 0.498 0.167 0.74 0.451 0.302 0.455 0.01 0.033 0.353 0.149 0.407 Compound_2868 CC(CCc1nc(NCc2ccccc2)nc(c1)N(C(=O)OC(C)(C)C)CC(C)C)C 0.49 0.644 0.494 0.545 0.31 0.896 0.021 0.568 0.284 0.104 0.269 Compound_2869 CC(CNc1nc(CCc2cccc3c2cccc3)cc(n1)NCc1cccc2c1cccc2)C 0.389 0.472 0.387 0.445 0.876 0.949 0.677 0.358 0.335 0.024 0.472 Compound_2870 CC(CCc1nc(NCc2cccc3c2cccc3)nc(c1)N(C(=O)OC(C)(C)C)CC(C)C)C 0.512 0.622 0.607 0.574 0.609 0.932 0.569 0.71 0.361 0.235 0.367 Compound_2871 CC(CCc1cc(nc(n1)S(=O)(=O)Cc1ccccc1)S(=O)(=O)Cc1ccccc1)C 0.574 0.473 0.828 0.493 0.649 0.762 0.814 0.352 0.192 0.098 0.076 Compound_2872 CC(CS(=O)(=O)c1cc(CCc2ccccc2)nc(n1)S(=O)(=O)CC(C)C)C 0.582 0.491 0.753 0.459 0.509 0.732 0.261 0.329 0.245 0.691 0.089 Compound_2873 c1ccc(cc1)CNc1cc(CCc2cccc3c2cccc3)nc(n1)NCc1cccc2c1cccc2 0.397 0.543 0.706 0.556 0.926 0.92 0.573 0.664 0.368 0.161 0.721 Compound_2874 CC(CNc1cc(OCC(C)C)nc(n1)NCC(C)C)C 0.335 0.295 0.74 0.451 0.154 0.331 0.018 0.033 0.336 0.374 0.213 Compound_2875 CC(CSc1cc(CCc2ccccc2)nc(n1)SCC(C)C)C 0.585 0.485 0.479 0.541 0.619 0.832 0.537 0.349 0.153 0.222 0.422 Compound_2876 CC(CCc1nc(NCC(C)C)cc(n1)NCC(C)C)C 0.126 0.335 0.823 0.393 0.176 0.597 0.018 0.376 0.214 0.012 0.044 Compound_2877 CC(CNc1nc(NCC(C)C)nc(c1)S(=O)(=O)CC(C)C)C 0.505 0.338 0.501 0.339 0.335 0.479 0.007 0.212 0.385 0.197 0.258 Compound_2878 CC(CCc1cc(CCC(C)C)nc(n1)NCc1cccc2c1cccc2)C 0.55 0.498 0.929 0.543 0.708 0.958 0.403 0.46 0.322 0.085 0.205 Compound_2879 c1ccc(cc1)CNc1nc(CCc2cccc3c2cccc3)cc(n1)NCc1cccc2c1cccc2 0.397 0.543 0.706 0.556 0.926 0.92 0.573 0.664 0.368 0.161 0.721 Compound_2880 O=S(=O)(c1cc(CCc2ccccc2)nc(n1)S(=O)(=O)Cc1ccccc1)Cc1ccccc1 0.565 0.446 0.539 0.505 0.75 0.773 0.491 0.321 0.208 0.476 0.109 Compound_2881 CC(CNc1cc(NCC(C)C)nc(n1)CCc1cccc2c1cccc2)C 0.176 0.468 0.674 0.451 0.54 0.93 0.379 0.381 0.438 0.128 0.203 Compound_2882 CC(CN(C(=O)OC(C)(C)C)c1cc(CCc2cccc3c2cccc3)nc(n1)NCc1ccccc1)C 0.454 0.631 0.563 0.582 0.801 0.922 0.87 0.835 0.373 0.201 0.404 Compound_2883 O=C(N(c1cc(C=Cc2ccccc2)nc(n1)NCc1cccc2c1cccc2)Cc1cccc2c1cccc2)OC(C)(C)C 0.681 0.649 0.629 0.665 0.893 0.901 0.837 0.945 0.367 0.782 0.611 Compound_2884 c1ccc(cc1)CCc1cc(SCc2ccccc2)nc(n1)SCc1ccccc1 0.505 0.505 0.472 0.518 0.861 0.876 0.767 0.791 0.172 0.55 0.673 Compound_2885 CC(CNc1nc(CCc2cccc3c2cccc3)cc(n1)N(C(=O)OC(C)(C)C)Cc1cccc2c1cccc2)C 0.471 0.631 0.33 0.465 0.854 0.925 0.87 0.761 0.358 0.201 0.404 Compound_2886 CC(CCc1nc(NCc2ccccc2)cc(n1)NCC(C)C)C 0.261 0.451 0.851 0.438 0.218 0.867 0.004 0.61 0.274 0.042 0.083 Compound_2887 O=C(N(c1cc(CCc2cccc3c2cccc3)nc(n1)NCc1cccc2c1cccc2)Cc1ccccc1)OC(C)(C)C 0.505 0.631 0.324 0.596 0.893 0.901 0.837 0.88 0.365 0.236 0.47 Compound_2888 c1ccc(cc1)C=Cc1nc(NCc2cccc3c2cccc3)nc(c1)C=Cc1ccccc1 0.685 0.741 0.985 0.666 0.917 0.932 0.602 0.849 0.366 0.297 0.755 Compound_2889 CC(CN(C(=O)OC(C)(C)C)c1cc(CCc2cccc3c2cccc3)nc(n1)NCc1cccc2c1cccc2)C 0.451 0.631 0.563 0.587 0.87 0.92 0.87 0.835 0.361 0.201 0.404 Compound_2890 CC(CNc1nc(CCc2ccccc2)cc(n1)N(C(=O)OC(C)(C)C)Cc1ccccc1)C 0.443 0.653 0.104 0.478 0.667 0.953 0.64 0.82 0.254 0.087 0.303 Compound_2891 CC(CN(C(=O)OC(C)(C)C)c1cc(CCc2ccccc2)nc(n1)NCc1ccccc1)C 0.43 0.653 0.357 0.565 0.704 0.949 0.64 0.753 0.283 0.087 0.303 Compound_2892 CC(CN(c1cc(CCc2cccc3c2cccc3)nc(n1)N(CC(C)C)C)C)C 0.204 0.634 0.257 0.452 0.688 0.946 0.244 0.314 0.322 0.228 0.258 Compound_2893 CC(CCc1cc(nc(n1)S(=O)(=O)CC(C)C)S(=O)(=O)CC(C)C)C 0.562 0.447 0.824 0.447 0.449 0.656 0.303 0.4 0.232 0.582 0.072 Compound_2894 O=C(N(c1cc(CCc2cccc3c2cccc3)nc(n1)NCc1ccccc1)Cc1cccc2c1cccc2)OC(C)(C)C 0.505 0.631 0.313 0.581 0.893 0.901 0.837 0.884 0.374 0.236 0.47 Compound_2895 CC(CCc1cc(nc(n1)N(CC(C)C)C)N(CC(C)C)C)C 0.259 0.447 0.327 0.392 0.272 0.821 0.032 0.183 0.136 0.068 0.076 Compound_2896 c1ccc(cc1)CNc1cc(NCc2ccccc2)nc(n1)NCc1ccccc1 0.525 0.638 0.391 0.498 0.731 0.935 0.602 0.053 0.55 0.185 0.637 Compound_2897 CC(CNc1nc(CCc2cccc3c2cccc3)cc(n1)N(C(=O)OC(C)(C)C)Cc1ccccc1)C 0.474 0.631 0.341 0.485 0.777 0.928 0.87 0.836 0.363 0.201 0.404 Compound_2898 CC(CNc1cc(C=Cc2ccccc2)nc(n1)N(CC(C)C)C)C 0.465 0.597 0.15 0.409 0.318 0.877 0.003 0.487 0.154 0.362 0.23 Compound_2899 CC(CCc1nc(NCc2ccccc2)nc(c1)N(C(=O)OC(C)(C)C)Cc1cccc2c1cccc2)C 0.583 0.622 0.607 0.564 0.801 0.922 0.87 0.71 0.37 0.235 0.367 Compound_2900 CC(CCc1nc(NCC(C)C)nc(c1)N(C(=O)OC(C)(C)C)Cc1cccc2c1cccc2)C 0.539 0.622 0.618 0.446 0.57 0.938 0.569 0.778 0.359 0.235 0.367 Compound_2901 c1ccc(cc1)CNc1cc(CCc2cccc3c2cccc3)nc(n1)NCc1ccccc1 0.399 0.543 0.706 0.548 0.892 0.932 0.573 0.664 0.368 0.161 0.721 Compound_2902 CC(CNc1cc(CCc2ccccc2)nc(n1)N(CC(C)C)C)C 0.202 0.524 0.027 0.345 0.357 0.94 0.009 0.355 0.147 0.119 0.168 Compound_2903 CC(CCc1cc(NCC(C)C)nc(n1)SCC(C)C)C 0.405 0.287 0.644 0.381 0.266 0.571 0.012 0.208 0.141 0.032 0.104 Compound_2904 CC(CN(c1cc(C=Cc2ccccc2)nc(n1)N(CC(C)C)C)C)C 0.54 0.657 0.479 0.513 0.394 0.932 0.003 0.438 0.155 0.578 0.187 Compound_2905 CC(CCc1cc(CCC(C)C)nc(n1)NCC(C)C)C 0.314 0.336 0.847 0.348 0.298 0.83 0.046 0.474 0.148 0.021 0.052 Compound_2906 CC(CCc1nc(NCC(C)C)nc(c1)N(CC(C)C)C)C 0.208 0.369 0.917 0.304 0.212 0.798 0.022 0.275 0.139 0.035 0.082 Compound_2907 CC(CCc1nc(NCC(C)C)nc(c1)N(C(=O)OC(C)(C)C)Cc1ccccc1)C 0.505 0.644 0.478 0.47 0.275 0.904 0.021 0.834 0.258 0.104 0.269 Compound_2908 CC(CN(c1cc(CCc2ccccc2)nc(n1)N(CC(C)C)C)C)C 0.177 0.594 0.087 0.406 0.431 0.942 0.008 0.172 0.146 0.112 0.151 Compound_2909 CC(CCc1cc(NCC(C)C)nc(n1)S(=O)(=O)CC(C)C)C 0.398 0.448 0.651 0.331 0.25 0.533 0.005 0.368 0.234 0.155 0.085 Compound_2910 CC(CCc1cc(SCc2ccccc2)nc(n1)SCc1ccccc1)C 0.543 0.461 0.817 0.51 0.771 0.868 0.873 0.54 0.15 0.027 0.473 Compound_2911 CN(c1ccc(nc1C(F)(F)F)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)Cc1cccc(c1)C(=O)O 0.526 0.66 0.501 0.469 0.952 0.715 0.996 0.931 0.439 0.658 0.711