Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	O=C(c1ccccc1)Nc1ccccc1SSc1ccccc1NC(=O)c1ccccc1	0.882	0.548	0.97	0.692	0.873	0.898	0.958	0.583	0.734	0.975	0.774
Compound_2	O=CC(=O)c1ccccc1	0.823	0.155	0.757	0.54	0.043	0.561	0.997	0.516	0.703	0.749	0.821
Compound_3	N#Cc1ccccc1	0.979	0.231	0.661	0.601	0.278	0.04	0.995	0.564	0.923	0.991	0.834
Compound_4	c1ccc(cc1)[Sn+](c1ccccc1)c1ccccc1	0.973	0.554	0.736	0.557	0.994	0.994	1.0	0.853	0.979	0.998	0.763
Compound_5	F[Sn](c1ccccc1)(c1ccccc1)c1ccccc1	0.952	0.451	0.763	0.676	0.994	0.992	1.0	0.964	0.98	0.999	0.769
Compound_6	Cl[Hg]c1ccccc1	0.99	0.493	0.828	0.676	0.684	0.822	0.999	0.968	0.984	1.0	0.918
Compound_7	c1ccc(cc1)[Hg]c1ccccc1	0.916	0.604	0.763	0.532	0.925	0.962	1.0	0.938	0.979	0.999	0.96
Compound_8	O=[As]c1ccccc1	0.844	0.451	0.403	0.538	0.905	0.898	0.999	0.121	0.957	1.0	0.749
Compound_9	OC/C=C/c1ccccc1	0.801	0.134	0.355	0.646	0.073	0.302	0.975	0.739	0.683	0.242	0.577
Compound_10	c1ccc(cc1)/C=C/c1ccncc1	0.52	0.706	0.787	0.64	0.042	0.598	0.01	0.078	0.95	0.902	0.748
Compound_11	c1ccc(cc1)/C=C/c1ccccc1	0.935	0.631	0.875	0.63	0.164	0.359	0.999	0.948	0.971	0.996	0.882
Compound_12	O=C/C=C/c1ccccc1	0.95	0.234	0.807	0.726	0.069	0.544	0.999	0.89	0.973	0.998	0.734
Compound_13	O=N(=O)/C=C/c1ccccc1	0.889	0.261	0.642	0.516	0.041	0.645	0.892	0.955	0.95	0.991	0.918
Compound_14	Clc1nc(nc(n1)Cl)Nc1ccccc1Cl	0.904	0.708	0.986	0.561	0.436	0.696	0.274	0.906	0.8	0.9	0.264
Compound_15	Nc1ccc(cc1)C(=O)Nc1ccccc1N	0.896	0.771	0.942	0.68	0.276	0.898	0.969	0.077	0.95	0.976	0.963
Compound_16	O=N(=O)c1ccccc1N	0.981	0.175	0.965	0.555	0.386	0.043	0.961	0.998	0.699	0.995	0.851
Compound_17	ClCc1ccccc1N(=O)=O	0.947	0.143	0.785	0.704	0.454	0.274	1.0	0.998	0.674	0.991	0.958
Compound_18	Fc1ccccc1c1onc(n1)c1cccc(c1)C(=O)O	0.273	0.461	0.952	0.763	0.757	0.899	0.621	0.391	0.673	0.254	0.131
Compound_19	OC(=O)c1ccccc1c1ccc(cc1)C(F)(F)F	0.676	0.285	0.259	0.446	0.594	0.536	0.998	0.915	0.511	0.658	0.622
Compound_20	O=Cc1ccccc1S(=O)(=O)[O-]	0.894	0.422	0.228	0.4	0.201	0.487	0.931	0.738	0.366	0.948	0.051
Compound_21	O=Cc1ccccc1C=O	0.951	0.096	0.403	0.548	0.051	0.212	0.995	0.088	0.95	0.843	0.918
Compound_22	O=N(=O)c1ccccc1N(=O)=O	0.994	0.255	0.912	0.571	0.452	0.05	0.997	0.994	0.706	0.999	0.936
Compound_23	[O-]S(=O)(=O)c1ccccc1/C=C/c1ccc(cc1)c1ccc(cc1)/C=C/c1ccccc1S(=O)(=O)[O-]	0.952	0.62	0.893	0.61	0.905	0.777	0.793	0.969	0.451	0.985	0.058
Compound_24	O=n1ccccc1SSc1ccccn1=O	0.952	0.484	0.913	0.524	0.476	0.708	0.967	0.856	0.95	0.986	0.918
Compound_25	[S-]c1ccccn1=O	0.623	0.253	0.913	0.557	0.091	0.209	0.823	0.785	0.955	0.991	0.918
Compound_26	S=c1ccccn1[O-]	0.391	0.364	0.349	0.474	0.316	0.561	0.822	0.072	0.764	0.877	0.872
Compound_27	OC[C@H]1O[C@@H](Oc2cc3ccc(=O)oc3cc2O)[C@@H]([C@H]([C@@H]1O)O)O	0.606	0.22	0.092	0.33	0.905	0.098	0.187	0.175	0.563	0.153	0.918
Compound_28	O=C1C=CC(=O)N1	0.381	0.341	0.379	0.442	0.085	0.066	0.334	0.978	0.817	0.977	0.762
Compound_29	O=C1C=CC(=O)C=C1	0.912	0.223	0.637	0.661	0.216	0.144	0.927	0.963	0.953	0.991	0.811
Compound_30	OCCOc1ccc(cc1)OCCO	0.544	0.104	0.476	0.578	0.529	0.378	0.523	0.481	0.173	0.381	0.315
Compound_31	OCC(COc1ccc(cc1)Cl)O	0.101	0.132	0.443	0.509	0.236	0.17	0.04	0.028	0.086	0.33	0.205
Compound_32	Fc1ccc(cc1)Oc1ccnc2c1c(Cl)cc(c2)Cl	0.952	0.786	0.983	0.601	0.942	0.683	0.581	0.921	0.956	0.996	0.994
Compound_33	Oc1ccc(cc1)O	0.926	0.165	0.846	0.588	0.393	0.113	0.958	0.283	0.91	0.142	0.466
Compound_34	Oc1ccc(cc1)Cl	0.898	0.17	0.711	0.593	0.312	0.098	0.634	0.118	0.877	0.81	0.648
Compound_35	Cl[Hg]c1ccc(cc1)O	0.967	0.307	0.738	0.707	0.905	0.898	0.954	0.976	0.952	0.956	0.918
Compound_36	ONc1ccc(cc1)N=O	0.972	0.598	0.993	0.677	0.084	0.731	0.965	0.959	0.924	0.733	0.592
Compound_37	O=C(Nc1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)Cl	0.943	0.658	0.994	0.784	0.597	0.898	0.981	0.963	0.533	0.96	0.918
Compound_38	O=Nc1ccc(cc1)O	0.892	0.353	0.987	0.685	0.728	0.408	0.986	0.783	0.962	0.92	0.879
Compound_39	O=C=Nc1ccc(cc1)Cl	0.851	0.587	0.862	0.694	0.347	0.474	0.999	0.897	0.792	0.97	0.795
Compound_40	Nc1ccc(cc1)Oc1ccc(cc1)N	0.801	0.79	0.952	0.695	0.737	0.969	0.99	0.983	0.943	0.971	0.99
Compound_41	Nc1ccc(cc1)Oc1ccc(cc1)Cl	0.831	0.762	0.911	0.774	0.714	0.974	0.967	0.973	0.772	0.987	0.989
Compound_42	Nc1ccc(cc1)O	0.643	0.381	0.948	0.701	0.414	0.314	0.943	0.836	0.95	0.465	0.918
Compound_43	Nc1ccc(cc1)N	0.915	0.265	0.963	0.645	0.075	0.557	0.985	0.956	0.964	0.962	0.752