Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CC(CC(NC1=CC(=O)C(=CC1=O)Nc1ccccc1)C)C	0.239	0.478	0.874	0.444	0.397	0.345	0.01	0.5	0.511	0.798	0.759
Compound_2	CC(=C)CC(=C)NC1=CC(=O)C(=CC1=O)Nc1ccccc1	0.191	0.48	0.7	0.56	0.489	0.453	0.045	0.975	0.674	0.693	0.79
Compound_3	CC(=C)CC(=O)C	0.909	0.106	0.318	0.554	0.03	0.0	0.664	0.94	0.666	0.998	0.95
Compound_4	CC(=C)CC(Nc1c(O)cc(c(c1SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)O)Nc1ccccc1)C	0.505	0.548	0.62	0.386	0.717	0.645	0.078	0.484	0.169	0.245	0.29
Compound_5	CC(CC(=C)NC1=C(SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)C(=O)C(=CC1=O)Nc1ccccc1)C	0.386	0.511	0.19	0.437	0.718	0.414	0.019	0.258	0.161	0.106	0.241
Compound_6	O=C1C=C(N)C(=O)C=C1Nc1ccccc1	0.257	0.522	0.933	0.66	0.487	0.394	0.326	0.769	0.799	0.683	0.957
Compound_7	O=C1C=C(N)C(=O)C=C1NC1=CC=CC2C1O2	0.452	0.682	0.036	0.434	0.947	0.74	0.823	0.464	0.594	0.573	0.859
Compound_8	CC(C(C(=O)C)O)C	0.619	0.081	0.046	0.47	0.012	0.017	0.967	0.023	0.274	0.286	0.722
Compound_9	CC(CC(N)C)C	0.125	0.048	0.427	0.361	0.007	0.014	0.001	0.009	0.668	0.663	0.191
Compound_10	CC(NC1=CC(=O)C(=O)CC1=O)CC(C)C	0.217	0.34	0.166	0.392	0.255	0.221	0.004	0.252	0.388	0.178	0.267
Compound_11	Oc1ccccc1O	0.927	0.135	0.819	0.612	0.494	0.018	0.962	0.91	0.852	0.947	0.647
Compound_12	CC(CC(Nc1cc(O)c(c(c1O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)Nc1ccccc1)C)C	0.469	0.59	0.829	0.389	0.721	0.645	0.075	0.242	0.208	0.316	0.149
Compound_13	NC1=CC(=O)C(=CC1=O)N	0.248	0.415	0.345	0.637	0.174	0.079	0.119	0.493	0.798	0.419	0.869
Compound_14	OC1CC(N)C(CC1Nc1ccccc1)O	0.261	0.474	0.236	0.361	0.254	0.163	0.003	0.638	0.13	0.009	0.46
Compound_15	OC(=O)C(=O)CC=C	0.394	0.078	0.066	0.272	0.1	0.007	0.978	0.959	0.007	0.248	0.514
Compound_16	OC(=O)C=CC=CC(=O)O	0.673	0.07	0.106	0.3	0.535	0.069	0.894	0.846	0.873	0.317	0.843
Compound_17	CC(Nc1coc(=O)c(c(c1=O)O)O)CC(C)C	0.142	0.455	0.773	0.376	0.423	0.327	0.015	0.149	0.358	0.734	0.227
Compound_18	CC(CC(NC1CC(O)C(CC1=O)Nc1ccccc1)C)C	0.231	0.551	0.533	0.269	0.194	0.082	0.001	0.275	0.145	0.437	0.277
Compound_19	OC1CC(=O)C(CC1Nc1ccccc1)O	0.25	0.519	0.218	0.314	0.198	0.133	0.057	0.204	0.096	0.015	0.268
Compound_20	CC(NC1CC(O)C(=O)CC1O)CC(C)C	0.01	0.368	0.047	0.209	0.037	0.069	0.002	0.035	0.084	0.05	0.061
Compound_21	CC(CC(NC1CC(O)C(CC1O)Nc1ccc(c(c1O)O)O)C)C	0.249	0.606	0.577	0.299	0.668	0.32	0.001	0.603	0.273	0.662	0.302
Compound_22	OCC(CC(NC1=CC(=O)C(=CC1=O)Nc1ccccc1)C)C	0.228	0.577	0.094	0.398	0.353	0.355	0.013	0.106	0.196	0.005	0.213
Compound_23	OCC(NC1=CC(O)C(=CC1=O)Nc1ccccc1)CC(C)C	0.308	0.572	0.563	0.369	0.443	0.163	0.005	0.122	0.213	0.009	0.134
Compound_24	CC(CC(NC1=C(O)C(=O)C(=C(C1=O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)Nc1ccccc1)C)C	0.441	0.561	0.346	0.344	0.523	0.441	0.045	0.026	0.199	0.094	0.211
Compound_25	CC(=C)CC(NC1=CC(=O)C(=CC1=O)Nc1ccccc1)C	0.221	0.509	0.71	0.491	0.357	0.338	0.015	0.982	0.417	0.582	0.779
Compound_26	OCC(NC1=CC(=O)C(=CC1=O)Nc1ccccc1)CC(=C)C	0.219	0.578	0.32	0.403	0.318	0.172	0.023	0.739	0.15	0.015	0.535
Compound_27	OCC(NC1=CC(=O)C(=CC1=O)NC1=CC=CC2C1O2)CC(C)C	0.505	0.641	0.12	0.378	0.929	0.729	0.015	0.281	0.338	0.049	0.307
Compound_28	CC(c1ccc(cc1)O)(CC(C)(C)C)C	0.923	0.085	0.458	0.575	0.743	0.902	0.823	0.151	0.654	0.65	0.124
Compound_29	Oc1ccc(cc1O)C(CC(C)(C)C)(C)C	0.962	0.112	0.474	0.594	0.866	0.241	0.746	0.861	0.282	0.962	0.272
Compound_30	OC(=O)C1OC(Oc2ccc(cc2O)C(CC(C)(C)C)(C)C)C(C(C1O)O)O	0.378	0.516	0.013	0.46	0.646	0.187	0.106	0.471	0.2	0.77	0.1
Compound_31	O=CC(c1ccc(cc1)O)(CC(C)(C)C)C	0.782	0.151	0.478	0.592	0.657	0.905	0.703	0.244	0.656	0.176	0.088
Compound_32	OCC(c1ccc(cc1)OS(=O)(=O)O)(CC(C)(C)C)C	0.224	0.329	0.126	0.266	0.556	0.706	0.739	0.151	0.185	0.222	0.276
Compound_33	O=CC(=CC=C(C(=O)[O-])O)C(CC(C)(C)C)(C)C	0.865	0.074	0.125	0.475	0.273	0.626	0.742	0.994	0.536	0.667	0.933
Compound_34	OC(=O)C=C(C(CC(C)(C)C)(C)C)C=CC(=O)O	0.836	0.074	0.179	0.321	0.76	0.499	0.857	0.783	0.796	0.877	0.871
Compound_35	OC(=O)C1OC(Oc2ccc(cc2)C(CC(C)(C)C)(C)C)C(C(C1O)O)O	0.269	0.511	0.023	0.451	0.46	0.394	0.394	0.388	0.24	0.689	0.061
Compound_36	OCC(c1ccc(c(c1)O)O)(CC(C)(C)C)C	0.763	0.231	0.217	0.55	0.827	0.172	0.799	0.331	0.167	0.403	0.118