Index SMILES AR AR-LBD AhR Aromatase ER ER-LBD PPAR-gamma ARE ATAD5 HSE p53 Compound_1 Brc1cc(Br)cc(c1Oc1nc(nc(n1)Oc1c(Br)cc(cc1Br)Br)Oc1c(Br)cc(cc1Br)Br)Br 0.941 0.448 0.898 0.713 0.682 0.664 0.868 0.729 0.422 0.56 0.852 Compound_2 Clc1c2C3/N=C/4\N=C(c5c4c(Cl)c(c(c5Cl)Cl)Cl)/N=c/4\n5[Cu]N3/C(=N\C3N=C(/N=c\5/c5c4c(Cl)c(c(c5Cl)Cl)Cl)c4c3c(Cl)cc(c4Cl)Cl)/c2c(c(c1Cl)Cl)Cl 0.706 0.746 0.759 0.631 0.714 0.655 0.969 0.984 0.603 0.967 0.715 Compound_3 CCN(c1ccc(cc1)[C+](c1ccc(cc1)N(CC)CC)c1ccc(cc1)N(CC)CC)CC 0.861 0.749 0.8 0.543 0.89 0.996 0.908 0.772 0.731 0.988 0.78 Compound_4 OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O 0.024 0.057 0.014 0.029 0.168 0.007 0.002 0.866 0.64 0.017 0.28 Compound_5 ClC1C2C3[N-]C(C2C(C(C1Cl)Cl)Cl)NC1NC(C2C1C(Cl)C(C(C2Cl)Cl)Cl)NC1NC([N-]C2NC(N3)C3C2C(Cl)C(C(C3Cl)Cl)Cl)C2C1C(Cl)C(C(C2Cl)Cl)Cl 0.34 0.536 0.163 0.358 0.835 0.656 0.458 0.56 0.753 0.925 0.533 Compound_6 ClC1=C(Cl)C2(C(C1(Cl)C1C2CCC2C(CC1)C1(Cl)C(=C(C2(C1(Cl)Cl)Cl)Cl)Cl)(Cl)Cl)Cl 0.988 0.691 0.657 0.646 0.864 0.647 0.983 0.597 0.226 1.0 0.752 Compound_7 ClC12C(Cl)(Cl)C3(C4(C1(Cl)C1(C2(Cl)C3(C4(C1(Cl)Cl)Cl)Cl)Cl)Cl)Cl 0.956 0.51 0.727 0.636 0.892 0.65 0.977 0.443 0.389 0.999 0.673 Compound_8 O=C(OOC(=O)CCC(=O)O)CCC(=O)O 0.54 0.082 0.075 0.177 0.212 0.12 0.347 0.231 0.493 0.055 0.268 Compound_9 Brc1c(Oc2c(Br)c(Br)c(c(c2Br)Br)Br)c(Br)c(c(c1Br)Br)Br 0.922 0.704 0.89 0.656 0.656 0.652 0.999 0.653 0.384 0.999 0.995 Compound_10 O=C1C(c2ccc3c(n2)c(ccc3)N2C(=O)c3c(C2=O)c(Cl)c(c(c3Cl)Cl)Cl)C(=O)c2c1c(Cl)c(c(c2Cl)Cl)Cl 0.715 0.606 0.982 0.504 0.765 0.674 0.949 0.997 0.442 0.429 0.926