Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	FCCCN1CC[C@@H](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_2	OC(=O)/C=C/c1ccc(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_3	CC/C(=C(\c1cccc2c1cn[nH]2)/c1ccc(cc1)/C=C/C(=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_4	FCCCN1CC(C1)Nc1ccc(nc1)[C@H]1N(CC(F)(F)F)[C@H](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_5	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_6	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(cc1C(F)(F)F)F)O	0.544	0.578	0.352	0.46	0.988	0.801	0.783	0.89	0.203	0.696	0.351
Compound_7	FCCCNCCOc1ncc(c(c1F)[C@H]1N(CC(CO)(F)F)[C@H](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_8	Oc1cccc(c1)C1=C(C)c2c(OC1c1ccc(cc1)OC[C@@H](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_9	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_10	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(cc1)OCC(F)(F)F)O	0.548	0.618	0.146	0.473	0.994	0.928	0.835	0.921	0.217	0.594	0.395
Compound_11	CC/C(=C(\c1cc2c([nH]1)cccc2)/c1ccc(cc1)/C=C/C(=O)O)/c1ccc(cc1Cl)C(F)(F)F	0.704	0.615	0.636	0.532	0.982	0.742	0.999	0.781	0.477	0.708	0.925
Compound_12	OC(=O)/C=C/c1ccc(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_13	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_14	FCCCNCCN(c1cc(F)c(c(c1)F)[C@H]1N(CC(F)F)[C@H](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_15	FCCCN1CC[C@@H](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_16	Oc1ccc2c(c1)CCN(C2(C)c1ccc(cc1)OCCN1CCCC1)c1cccc(c1)F	0.59	0.771	0.315	0.461	0.904	0.771	0.049	0.609	0.481	0.31	0.787
Compound_17	CC/C(=C(\c1ccc2c(c1)cnn2C)/c1ccc(cc1)/C=C/C(=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_18	OC(=O)/C=C/c1cc(F)c(c(c1)F)[C@@]12CCC[C@@H](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_19	OC(=O)/C=C/c1ccc(cc1)[C@H]1N(CC(F)(C)C)[C@H](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_20	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(cc1Cl)Cl)O	0.593	0.605	0.272	0.474	0.993	0.909	0.022	0.871	0.299	0.844	0.479
Compound_21	Oc1ccc(cc1)[C@@H]1Sc2cc(C)c(cc2O[C@@H]1c1ccc(cc1)OCCN1CCCCC1)O	0.51	0.593	0.284	0.53	0.601	0.531	0.042	0.524	0.331	0.696	0.739
Compound_22	FCCCN1CC(C1)Nc1ccc(nc1)[C@H]1N(CC(F)(F)C)[C@H](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_23	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)CCCN1CCCCC1	0.479	0.551	0.061	0.347	0.853	0.716	0.108	0.199	0.192	0.113	0.535
Compound_24	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(c(c2=CCCC1c1ccc(cc1F)OC(F)(F)F)F)O	0.54	0.598	0.063	0.452	0.991	0.853	0.787	0.738	0.16	0.487	0.33
Compound_25	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_26	CCc1cc(O)cc2c1C(=O)C(C(O2)c1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)O	0.476	0.625	0.148	0.493	0.918	0.931	0.847	0.64	0.274	0.666	0.692
Compound_27	FCCCNCCOc1ncnc(c1C)C1N(CC(CO)(F)F)[C@H](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_28	C[C@@H]1CCN(C1)[C@H](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_29	FCCCN1CC(C1)Nc1ccc(nc1)[C@H]1N(CC2(F)CC2)[C@H](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_30	COc1cc(O)c(c2c1oc(c2)c1ccc(cc1)O)Br	0.57	0.601	0.967	0.744	0.697	0.647	0.715	0.993	0.628	0.896	0.984
Compound_31	CC/C(=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_32	FCCCN1CC[C@@H](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_33	COc1cc(/C=C/c2ccc(cc2)OS(=O)(=O)[C@@H]2CC3=C(C(C2O3)c2ccc(cc2)O)c2ccc(cc2)O)cc(c1)OC	0.749	0.735	0.499	0.685	0.975	0.859	0.899	0.512	0.402	0.758	0.315
Compound_34	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCN1CC2CCC1CC2	0.499	0.572	0.143	0.541	0.894	0.682	0.037	0.376	0.288	0.922	0.892
Compound_35	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_36	CCCCCCCCCCNCCOc1ccc(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_37	FCCCNCCOc1ccc(c(c1Cl)[C@H]1N(CC(C(=O)O)(C)C)[C@H](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_38	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCN1CCC2(CC1)OCCO2	0.483	0.544	0.116	0.558	0.87	0.679	0.039	0.472	0.345	0.848	0.803
Compound_39	CCCCc1cc2ccccc2c(c1c1ccc(cc1)O)Oc1ccc(cc1)/C=C/C(=O)O	0.768	0.678	0.287	0.52	0.995	0.988	0.409	0.95	0.828	0.951	0.537
Compound_40	OC[C@@H]1CCCN1CCOc1ccc(cc1)[C@@H]1Oc2ccc(cc2S[C@@H]1c1ccc(cc1)O)O	0.459	0.578	0.132	0.504	0.836	0.654	0.008	0.084	0.214	0.905	0.737
Compound_41	FCC1CN(C1)CCOc1ccc(cc1)[C@H]1[C@H](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_42	N#Cc1cc(Cl)ccc1/C(=C(/c1ccc2n(c1)ccn2)\c1ccc(cc1)/C=C/C(=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_43	CC/C(=C(\c1cc2c([nH]1)cccc2)/c1ccc(cc1)/C=C/C(=O)O)/c1cccc(c1)C	0.641	0.717	0.406	0.429	0.964	0.794	0.998	0.399	0.716	0.262	0.923
Compound_44	C[C@@H]1CCN(C1)[C@H](COc1ccc(cc1)[C@@H]1Oc2ccc(c(c2[C@H]([C@@H]1c1ccc(cc1)O)C)F)O)C	0.395	0.711	0.149	0.496	0.957	0.674	0.035	0.759	0.201	0.945	0.855
Compound_45	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_46	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_47	Oc1ccc(cc1)C1=C(C)c2c(C1=O)c(O)cc(c2)O	0.842	0.811	0.805	0.617	0.957	0.96	0.933	0.906	0.603	0.954	0.901
Compound_48	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(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_49	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_50	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_51	C#C[C@]1(O)CC[C@@H]2C1(C)CC[C@H]1[C@H]2CCc2c1ccc(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_52	C[C@@H]1CCN(C1)[C@H](COc1ccc(cc1)[C@@H]1Oc2ccc(cc2[C@H]([C@@H]1c1ccc(cc1)O)C)O)C	0.29	0.696	0.222	0.426	0.955	0.692	0.032	0.832	0.151	0.933	0.928
Compound_53	FCCCNCCOc1ccc(c(c1C)[C@H]1N(CC2(CCC2)C(=O)O)[C@H](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_54	FCCCN1CC[C@@H](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_55	Oc1ccc(c(c1)O)c1oc2c(n1)ccc(c2)O	0.333	0.716	0.977	0.803	0.756	0.651	0.59	0.991	0.773	0.828	0.904
Compound_56	Oc1ccc(cc1)C1C(=C2OC1C(C2)S(=O)(=O)Oc1ccc(cc1)/C=C/c1cc(O)cc(c1)O)c1ccc(cc1)O	0.77	0.752	0.567	0.656	0.975	0.886	0.738	0.801	0.42	0.528	0.314
Compound_57	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc2c(c1)OC(O2)(F)F)O	0.594	0.584	0.169	0.422	0.98	0.777	0.931	0.81	0.219	0.883	0.261
Compound_58	C[C@@H](Oc1ccc(cc1)[C@@H]1Oc2ccc(cc2[C@H]([C@@H]1c1ccc(cc1)O)C)O)CN1CCCC1	0.307	0.633	0.111	0.374	0.957	0.71	0.091	0.498	0.187	0.689	0.751
Compound_59	FCCCNCCOc1ccc(c(c1Cl)[C@@H]1c2[nH]c3c(c2C[C@H](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_60	FCCCNCCOc1cnc(cn1)[C@H]1N(CC(CO)(F)F)[C@H](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_61	Oc1ccc(cc1)c1sc2c(c1C(=O)c1ccc(cc1)N1CCN(CC1)c1ccc(cc1)N(=O)=O)ccc(c2)O	0.868	0.54	0.955	0.846	0.881	0.722	0.909	0.963	0.491	0.748	0.73
Compound_62	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=C(CCCc2c1ccc(c2)O)c1cnc(=N)[nH]c1	0.611	0.526	0.314	0.464	0.781	0.64	0.038	0.842	0.158	0.224	0.538
Compound_63	FCCCN1CC[C@@H](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_64	COCC(CN1[C@H](C)Cc2c([C@H]1c1ccc(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_65	Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)OCCN1CCCCC1)c1ccc(cc1)C(C)C	0.662	0.531	0.337	0.788	0.834	0.715	0.708	0.897	0.296	0.154	0.431
Compound_66	OC(=O)/C=C/c1ccc(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_67	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_68	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_69	FCC1CN(C1)CCOc1cc(F)c(c(c1)OC)[C@H]1N(CC(CF)(F)F)[C@H](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_70	FCCCN(CCOc1ncc(c(c1C)[C@H]1N(CC(C(=O)O)C)[C@H](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_71	FCCCNCCOc1ccc(cc1)[C@H]1N(CC2(F)CC2)[C@H](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_72	FCCCN1CC[C@@H](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_73	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCN1C[C@H]([C@@H](C1)C)C	0.459	0.596	0.246	0.548	0.881	0.664	0.036	0.437	0.195	0.441	0.856
Compound_74	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_75	FC[C@@H]1CCN(C1)[C@H](COc1ccc(cc1)[C@H]1Oc2ccc(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_76	CCCc1nnc(o1)/C=C/c1ccc(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_77	FCCCNCCOc1ncc(c(c1Cl)[C@H]1N(CC(C(=O)O)C)[C@H](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_78	CCCC12CCC(=O)C(C2=c2c(=C1)cc(cc2)O)Br	0.621	0.916	0.647	0.674	0.829	0.693	0.92	0.954	0.455	1.0	0.941
Compound_79	COc1cc(cc2c1C(=O)N(C2)C1CCC(=O)NC1=O)N1CCN(CC1)CCC1CCN(CC1)c1ncc(cn1)[C@H]1N(CC(F)(C)C)[C@H](C)Cc2c1[nH]c1c2cccc1	0.63	0.693	0.527	0.397	0.742	0.652	0.998	0.764	0.416	0.99	0.723
Compound_80	Oc1cc2O[C@H](c3ccc(cc3)OCCN3CCCCC3)[C@@H](Sc2c(c1)O)c1ccc(cc1)O	0.455	0.593	0.161	0.562	0.767	0.507	0.198	0.444	0.356	0.891	0.79
Compound_81	FCCCNCCOc1nccc(c1Cl)[C@H]1N(CC(CO)(F)F)[C@H](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_82	O=S1C2C[C@@H](C1C(=C2c1ccc(cc1C)O)c1ccc(cc1C)O)S(=O)(=O)Oc1ccccc1Cl	0.697	0.725	0.724	0.645	0.895	0.793	0.372	0.75	0.405	0.965	0.299
Compound_83	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1C1CCOCC1)O	0.587	0.654	0.289	0.452	0.852	0.908	0.02	0.878	0.211	0.615	0.254
Compound_84	FCCCNCCOc1ccc(c(c1C)[C@H]1N(CC(F)(F)F)[C@H](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_85	COCc1cc(O)cc2c1O[C@@H](c1ccc(cc1)O)[C@@H]1[C@H]2CCC1	0.582	0.636	0.191	0.717	0.979	0.9	0.113	0.95	0.249	0.353	0.707
Compound_86	CCCC[C@]12CCC(=O)C(=C2c2c(C1)c1cn[nH]c1cc2)CC	0.788	0.9	0.912	0.547	0.762	0.68	0.63	0.961	0.566	0.763	0.898
Compound_87	FCC1CN(C1)CCOc1cc(F)c(c(c1)F)[C@H]1N(CC2(F)COC2)[C@H](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_88	C[C@H](Oc1ccc(cc1)[C@@H]1Oc2ccc(cc2S[C@@H]1c1ccc(cc1)O)O)CN1CCCC1	0.469	0.541	0.188	0.365	0.88	0.669	0.03	0.175	0.234	0.852	0.766
Compound_89	BrC(C(c1ccc(cc1)O)c1ccc(cc1)O)(Br)Br	0.888	0.738	0.077	0.661	0.828	0.855	0.999	0.876	0.749	0.926	0.997
Compound_90	FCCCN1CC(C1)Nc1ccc(c(c1)F)[C@H]1N(CC(CO)(F)F)[C@H](C)Cc2c1[nH]c1c2cccc1	0.54	0.587	0.957	0.204	0.883	0.682	0.889	0.622	0.35	0.029	0.405
Compound_91	Oc1ccc(cc1)N1C(=O)C([C@@H]1c1ccc(cc1)O)(c1ccccc1)c1ccccc1	0.582	0.606	0.689	0.543	0.954	0.824	0.334	0.313	0.234	0.014	0.674
Compound_92	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_93	FCC1CN(C1)CCOc1ccc(c(c1)F)[C@@H]1c2[nH]c3c(c2C[C@H](N1S(=O)(=O)C)C)cccc3	0.586	0.655	0.621	0.45	0.786	0.673	0.928	0.867	0.364	0.271	0.514
Compound_94	FCCCN1CC(C1)Nc1ccc(nc1F)[C@H]1N(CC(F)F)[C@H](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_95	FCCCN1CC(C1)Nc1ccc(c(c1)OC)[C@H]1N(CC(F)(F)C)[C@H](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_96	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_97	OC(=O)/C=C/c1ccc(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_98	Fc1cc(F)c2c(c1)c1ccc3c(c1[C@@H](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_99	FCC1CN(C1)CCOc1ccc(cc1)[C@@]1(C)N(CC2(F)COC2)[C@H](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_100	FCCCNCCOc1ccc(cc1)[C@H]1N(CC(F)(F)C)[C@H](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_101	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_102	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_103	FCCCN1CC(C1)Nc1cc(F)c(c(c1)F)[C@H]1N(CC(COC)(F)F)[C@H](C)Cc2c1[nH]c1c2cccc1	0.505	0.625	0.638	0.221	0.89	0.687	0.971	0.871	0.466	0.052	0.532
Compound_104	FCC1CN(C1)CCOc1ccc(c(c1)OC)[C@H]1N(CC(F)(C)C)[C@H](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_105	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(nc1)C(F)(F)F)O	0.571	0.604	0.089	0.432	0.969	0.722	0.953	0.876	0.066	0.673	0.519
Compound_106	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_107	Oc1ccc(cc1)C(=Nc1ccc(cc1)Br)c1ccc(cc1)O	0.826	0.76	0.817	0.744	0.74	0.656	0.995	0.537	0.665	0.945	0.976
Compound_108	CCCN1CC(C1)Nc1cc(F)c(c(c1)F)[C@H]1N(CC(CO)(F)F)[C@H](C)Cc2c1[nH]c1c2cccc1	0.458	0.553	0.839	0.185	0.883	0.682	0.889	0.582	0.384	0.388	0.482
Compound_109	FCCCNCCOc1ncc(c(c1C)[C@H]1N(CC(C(=O)O)C)[C@H](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_110	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_111	OC(=O)/C=C/c1ccc(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_112	CC[C@H](N1CCCC1)COc1ccc(cc1)[C@@H]1Oc2ccc(cc2S[C@@H]1c1ccc(cc1)O)O	0.455	0.568	0.254	0.476	0.879	0.666	0.016	0.392	0.216	0.862	0.924
Compound_113	Oc1ccc2c(c1)sc(c2C(c1ccc(cc1)OCCN1CCCCC1)O)c1ccc(cc1)O	0.735	0.383	0.529	0.799	0.82	0.669	0.462	0.782	0.411	0.979	0.889
Compound_114	COc1ccc(cc1)c1sc2c(c1Oc1ccc(cc1)OCCN1CCCCC1)ccc(c2)O	0.746	0.492	0.595	0.718	0.836	0.697	0.624	0.784	0.371	0.535	0.68
Compound_115	O=C(/C=C/c1ccc(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_116	FCCCN1CC[C@@H](C1)OC1CCC(CC1)C1C(=C2CCC3=NCCC3C2)CCCc2c1ccc(c2)O	0.646	0.649	0.491	0.389	0.708	0.801	0.077	0.814	0.289	0.669	0.376
Compound_117	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_118	FCC1CN(C1)CCOc1cc(F)c(c(c1)F)[C@H]1N(C[C@](CO)(F)C)[C@H](C)Cc2c1[nH]c1c2cccc1	0.482	0.643	0.141	0.419	0.89	0.665	0.916	0.728	0.318	0.132	0.535
Compound_119	Oc1ccc(cc1)[C@@H]1Oc2c(C)cc(cc2[C@H]2[C@@H]1CCC2)O	0.555	0.696	0.212	0.79	0.985	0.921	0.035	0.948	0.206	0.894	0.733
Compound_120	FCCCN[C@@H](COc1ccc(c(c1)[C@H]1N(CC(CO)(F)F)[C@H](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_121	CCCc1cc(c(cc1O)CC)c1noc2c1ccc(c2)O	0.5	0.706	0.809	0.637	0.952	0.968	0.989	0.98	0.87	0.589	0.819
Compound_122	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_123	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_124	FCCCNCCOc1ccc(cc1)[C@H]1N(CC(F)F)[C@H](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_125	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCCN1CCCC1	0.424	0.499	0.208	0.476	0.884	0.688	0.027	0.595	0.234	0.87	0.894
Compound_126	CCOC(=O)/C=C/c1ccc(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_127	CC(=O)/C=C/c1ccc(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_128	FCCCN1CC(C1)Nc1ccc(nc1)[C@H]1N(CC(C)C)[C@H](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_129	Oc1ccc2c(c1)sc(c2Oc1ccc(cc1)/C=C/c1nnc(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_130	FCC1CN(C1)CCOc1ccc(cc1)[C@@H]1c2[nH]c3c(c2C[C@H](N1S(=O)(=O)C)C)cccc3	0.561	0.676	0.505	0.367	0.743	0.674	0.297	0.862	0.366	0.179	0.506
Compound_131	OCCCCC(=C(c1ccc(cc1)O)c1ccc(cc1)OCCN(C)C)c1ccccc1	0.589	0.368	0.009	0.785	0.942	0.991	0.002	0.677	0.082	0.025	0.03
Compound_132	Oc1cc2O[C@H](c3ccc(cc3)OCCN3CCCCC3)[C@@H](Sc2c(c1)F)c1ccc(cc1)O	0.529	0.565	0.151	0.529	0.773	0.52	0.239	0.517	0.347	0.922	0.842
Compound_133	FCCCN1CC[C@@H](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_134	FCCCNCCOc1ncc(c(c1F)[C@H]1N(CC2(F)CC2)[C@H](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_135	FCCCNCCOc1cc(F)c(c(c1F)[C@H]1N(CC(F)(F)F)[C@H](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_136	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_137	Cc1ccc(cc1)N=C(c1ccc(cc1O)O)c1ccc(cc1)O	0.736	0.887	0.983	0.776	0.998	0.993	0.934	0.419	0.769	0.758	0.841
Compound_138	CC(NC(=O)Cc1c([nH]c2c1cccc2)c1ccccc1)CCc1ccccc1	0.206	0.611	0.589	0.471	0.695	0.736	0.998	0.82	0.344	0.293	0.328
Compound_139	CC1=CC(C)(C)[C@@]2(C[C@H]1[C@@H](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_140	CCCC(c1ccc(c(c1)C)O)(c1ccc(c(c1)C)O)CCC	0.945	0.732	0.676	0.583	0.905	0.995	0.382	0.961	0.648	1.0	0.988
Compound_141	FCCCNCCOc1ccnc(c1)[C@H]1N(CC(F)(F)F)[C@H](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_142	NCCCC[C@@H](C(=O)N[C@@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(C)C)Cc1[nH]cnc1)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CC(=O)O)CCC(=O)N)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(NC(=O)C)CCCN=C(N)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N	0.52	0.542	0.009	0.254	0.491	0.684	0.041	0.336	0.398	0.106	0.234
Compound_143	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_144	FCCCNCCNc1ccc(c(c1F)[C@H]1N(CC(CO)(F)F)[C@H](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_145	FCCCN1CC[C@@H](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_146	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc2c(c1)NCCC2)O	0.583	0.513	0.281	0.311	0.967	0.849	0.382	0.699	0.346	0.442	0.297
Compound_147	FCCCNCCOc1ccc(c(c1)[C@H]1N(CC(F)(F)F)[C@H](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_148	Oc1cccc(c1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCN1CCCC1	0.474	0.51	0.247	0.474	0.889	0.659	0.054	0.522	0.225	0.976	0.884
Compound_149	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_150	OC(=O)/C=C/c1ccc(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_151	FCC1CN(C1)CCOc1ccc(cc1)[C@H]1[C@H](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_152	FCCCN1CC[C@@H](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_153	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1C1CCC(CC1)O)O	0.498	0.628	0.12	0.387	0.902	0.922	0.04	0.705	0.213	0.7	0.228
Compound_154	OCCCCNC(=O)/C=C/c1ccc(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_155	FCC1CN(C1)CCOc1ccc(nc1)[C@H]1N(CC(C)C)[C@H](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_156	FCCCNCCOc1ncnc(c1C)C1N(CC(F)(F)F)[C@H](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_157	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_158	CCCCNC(=O)/C=C/c1ccc(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_159	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_160	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_161	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(cc1)C1COC1)O	0.534	0.577	0.138	0.442	0.956	0.895	0.126	0.874	0.18	0.667	0.468
Compound_162	CC[C@]12CCC(=O)C(=C2c2c(C1)c1cn[nH]c1cc2)c1ccccc1	0.715	0.826	0.899	0.468	0.857	0.703	0.959	0.687	0.517	0.122	0.923
Compound_163	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_164	FCCCNCCOc1ccc(cn1)[C@H]1N(CC2(F)CC2)[C@H](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_165	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_166	CC(CN1CCc2c([C@H]1c1ccc(cc1)/C=C/C(=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_167	OC(=O)/C=C/c1ccc(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_168	Oc1ccc2c(c1)OC(C1=C2CCOc2c1ccc(c2)O)c1ccc(cc1)OCCN1CCCCC1	0.587	0.746	0.248	0.523	0.931	0.702	0.234	0.29	0.266	0.954	0.289
Compound_169	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_170	OC(=O)/C=C/c1cc(F)c(c(c1)F)[C@@]1(C)N(CC(F)(C)C)[C@H](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_171	Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1C[C@H]([C@@H]2O)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_172	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_173	FCC1CN(C1)CCOc1ccc(cn1)[C@@H]1[C@@H](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_174	FCCCN1CC(C1)N(c1ccc(nc1)[C@H]1N(CC(F)F)[C@H](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_175	Oc1ccc(cc1)[C@H]1Sc2cc(O)ccc2O[C@H]1c1ccc(cc1)OCCN1CCC(C1)(C)C	0.45	0.653	0.155	0.529	0.894	0.684	0.03	0.387	0.236	0.601	0.915
Compound_176	Fc1ccc2c(c1)OCCC(=C2c1ccc(cc1)/C=C/C(=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_177	Oc1ccc(cc1)C(=Nc1ccccc1)c1ccc(cc1O)O	0.877	0.888	0.966	0.77	0.995	0.99	0.982	0.492	0.837	0.821	0.934
Compound_178	C[C@@H](NC(=O)Cc1c(c2ccccc2)n(c2c1cccc2)Cc1ccc(cc1)OCCN1CCCCC1)CCc1ccc(cc1)O	0.539	0.65	0.137	0.734	0.904	0.935	0.966	0.643	0.347	0.511	0.608
Compound_179	FCCCCN1CC(C1)Oc1cc(F)c(c(c1)F)[C@H]1N(CC(F)(C)C)[C@H](C)Cc2c1[nH]c1c2cccc1	0.457	0.678	0.069	0.346	0.881	0.666	0.881	0.638	0.427	0.921	0.435
Compound_180	FC[C@@H]1CCCN1CCOc1ccc(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_181	CCC(c1cc(C)c(c(c1)C)O)(c1cc(C)c(c(c1)C)O)CC	0.87	0.58	0.312	0.56	0.822	0.991	0.42	0.896	0.807	0.998	0.982
Compound_182	FCCCNCCNc1ccc(nc1)[C@H]1N(CC2(F)CC2)[C@H](C)Cc2c1ccc1c2cn[nH]1	0.563	0.742	0.684	0.237	0.705	0.688	0.983	0.597	0.277	0.002	0.311
Compound_183	Oc1ccc(cc1)[C@@H]1[C@@H](Oc2c([C@H]1C)c(F)c(cc2)O)c1ccc(cc1)OCCN1CCCCC1	0.409	0.592	0.064	0.535	0.939	0.704	0.104	0.639	0.243	0.825	0.609
Compound_184	Oc1ccc(cc1)CCN=c1[nH]c(SCCCc2ccc(cc2)Cl)nc(n1)N1CCNCC1	0.268	0.353	0.083	0.314	0.636	0.689	0.005	0.325	0.351	0.053	0.287
Compound_185	C[C@@H]1CCN(C1)[C@H](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_186	CCCCN(C(=O)CCCCCCCCCCSC1C(=O)c2cc(O)ccc2[C@@H]2[C@@H]1[C@@H]1CC[C@@H]([C@]1(CC2)C)O)C	0.671	0.776	0.014	0.608	0.888	0.969	0.078	0.346	0.358	0.166	0.694
Compound_187	COc1ccc(cc1)c1cn(c2ccc(cc2)O)c(=O)c2c1cc(O)cc2O	0.798	0.817	0.623	0.674	0.978	0.974	0.606	0.97	0.899	0.087	0.316
Compound_188	CCOC(=O)C1(Cc2c(C1)ccc(c2)[C@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1ccc(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_189	CCC(=C(c1ccc2c(c1)nn[nH]2)c1ccc(cc1)/C=C/C(=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_190	FCCCNCCOc1ccnc(c1F)C1N(CC2(F)COC2)[C@H](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_191	CCSC1=C(c2ccc(cc2)O)C(=O)c2c1ccc(c2)O	0.658	0.691	0.902	0.591	0.961	0.825	0.983	0.831	0.302	0.986	0.98
Compound_192	FCCCN[C@H](COc1ccc(cc1)[C@H]1N(CC2(F)COC2)[C@H](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_193	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_194	Oc1ccc(cc1)[C@@H]1Sc2ccccc2O[C@@H]1c1ccc(cc1)OCCN1CCCCC1	0.421	0.546	0.175	0.484	0.84	0.629	0.06	0.267	0.241	0.28	0.583
Compound_195	Oc1ccc2c(c1)sc1c2C(c2ccc(cc2)C(CCN2CCCCC2)O)c2c(C1)cccc2O	0.515	0.467	0.557	0.383	0.769	0.717	0.375	0.161	0.463	0.414	0.228
Compound_196	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_197	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(c(c2=CCCC1c1ccc(c(c1)F)OC(F)F)F)O	0.542	0.596	0.125	0.431	0.991	0.853	0.787	0.857	0.208	0.634	0.258
Compound_198	Oc1ccc(cc1)[C@@H]1Oc2ccc(cc2[C@H]2[C@@H]1C[C@H](C2)C(F)(F)F)O	0.547	0.622	0.234	0.739	0.998	0.916	0.553	0.974	0.112	0.925	0.978
Compound_199	FCCCN1CC(C1)Nc1ccc(nc1)[C@@]1(C)N(CC(F)F)[C@H](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_200	FCCCN1CC[C@@H](C1)Oc1ccc(cc1)C1=c2ccc(cc2=CCCC1c1ccc(cc1)OC(F)F)O	0.505	0.596	0.126	0.421	0.986	0.942	0.835	0.842	0.207	0.648	0.285
Compound_201	FCCCNCCOc1ccc(c(c1F)[C@H]1N(CC(C(=O)O)C)[C@H](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_202	FCC1CN(C1)CCNc1ccc(cc1)[C@@H]1[C@@H](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_203	Oc1ccc2c(c1)onc2c1ccc2c(c1)cccc2O	0.739	0.749	0.974	0.796	0.979	0.975	0.979	0.992	0.928	0.818	0.958
Compound_204	OC(=O)/C=C/c1ccc(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_205	FCCCN1CC[C@@H](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