Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CCn1nc(cc1C1CCN(CC1)C[C@H]1C[C@@H](C[C@@H]1c1cccc(c1)F)N([C@@H](C(=O)O)C(C)C)C)Cc1ccccc1	0.505	0.673	0.034	0.22	0.775	0.636	0.743	0.159	0.256	0.228	0.135
Compound_2	CCCCCCc1ccc(cc1)N	0.907	0.224	0.675	0.542	0.243	0.732	0.979	0.781	0.98	0.997	0.492
Compound_3	CC(CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C)C	0.835	0.002	0.658	0.693	0.093	0.053	0.996	0.551	0.289	0.99	0.859
Compound_4	O=C(c1cccnc1Oc1ccc2c(c1)non2)NCc1ccc(cc1)C(O)(C)C	0.494	0.588	0.641	0.536	0.722	0.646	0.994	0.099	0.443	0.007	0.494
Compound_5	N#CCCC(C#N)(CBr)Br	0.919	0.201	0.152	0.664	0.351	0.161	0.975	0.925	0.658	0.972	0.969
Compound_6	[O-]C(=O)COc1ccc(cc1C)Cl	0.156	0.186	0.721	0.539	0.069	0.079	0.1	0.794	0.511	0.94	0.685
Compound_7	[O-]CCN(CCO)CCO	0.053	0.038	0.138	0.133	0.02	0.023	0.008	0.56	0.761	0.084	0.456
Compound_8	OC(=O)c1cccc(c1)Oc1ccccc1	0.451	0.711	0.599	0.417	0.667	0.451	0.994	0.521	0.363	0.106	0.551
Compound_9	CC[N+](=C1C=CC(=C(c2ccccc2S(=O)(=O)[O-])c2ccc(cc2)N(Cc2cccc(c2)S(=O)(=O)[O-])CC)C=C1)Cc1cccc(c1)S(=O)(=O)[O-]	0.747	0.523	0.774	0.682	0.915	0.9	0.932	0.999	0.409	0.915	0.261
Compound_10	COc1cc(O)c(cc1S(=O)(=O)O)C(=O)c1ccccc1	0.648	0.559	0.885	0.524	0.093	0.098	0.942	0.049	0.499	0.478	0.145
Compound_11	OC(=O)[C@](Cc1ccc(c(c1)O)O)(N)C	0.23	0.085	0.034	0.237	0.093	0.054	0.431	0.014	0.215	0.001	0.001
Compound_12	CCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.284	0.221	0.617	0.695	0.19	0.099	0.377	0.886	0.284	0.474	0.799
Compound_13	CCCCOc1ccc(cc1)N	0.708	0.307	0.874	0.66	0.457	0.859	0.898	0.941	0.765	0.368	0.733
Compound_14	FC(Oc1cc(ccc1OC(F)F)N(c1cccc(c1)C(=O)O)Cc1cccnc1)F	0.321	0.569	0.577	0.497	0.835	0.098	0.989	0.448	0.26	0.029	0.768
Compound_15	OC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C	0.453	0.143	0.206	0.44	0.192	0.048	0.085	0.129	0.511	0.12	0.894
Compound_16	COC(=O)c1c(C)cc(c(c1O)C)O	0.745	0.202	0.878	0.505	0.776	0.953	0.702	0.156	0.824	0.225	0.248
Compound_17	Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1	0.92	0.905	0.984	0.897	0.909	0.898	0.992	0.984	0.902	0.181	0.93
Compound_18	OCC(=O)[C@H]1CC[C@@H]2[C@]1(C)C[C@H](O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C	0.959	1.0	0.015	0.889	0.588	0.933	0.006	0.078	0.031	0.142	0.071
Compound_19	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_20	Oc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O)C	0.97	0.991	0.009	0.489	0.991	0.99	0.02	0.286	0.049	0.998	0.918