Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	Oc1ccc2c(c1)oc(=O)c1c2oc2c1ccc(c2)O	0.464	0.525	0.979	0.661	0.785	0.777	0.977	0.958	0.95	0.913	0.671
Compound_2	O=C1c2ncccc2c2c(C1=O)nccc2	0.214	0.816	0.44	0.73	0.056	0.898	0.005	0.979	0.391	0.422	0.986
Compound_3	Oc1cccc2c1nccc2	0.69	0.785	0.662	0.579	0.23	0.456	0.129	0.923	0.451	0.996	0.966
Compound_4	Oc1cccc2c1C(=O)c1c(C2=O)cccc1O	0.925	0.811	0.947	0.796	0.818	0.917	0.967	0.992	0.785	0.212	0.991
Compound_5	Oc1cc(cc2c1C(=O)c1c(C2=O)cccc1O)C(=O)O	0.663	0.737	0.643	0.487	0.178	0.465	0.981	0.976	0.816	0.185	0.903
Compound_6	Clc1cc(Cl)c2c(c1O)nccc2	0.853	0.666	0.818	0.274	0.584	0.616	0.133	0.561	0.95	0.998	0.998
Compound_7	OCCc1ccccn1	0.035	0.183	0.737	0.406	0.021	0.157	0.024	0.777	0.36	0.006	0.372
Compound_8	[O-]S(=O)(=O)Oc1ccc(cc1)C(c1ccccn1)c1ccc(cc1)OS(=O)(=O)[O-]	0.083	0.582	0.261	0.443	0.757	0.955	0.873	0.529	0.348	0.503	0.5
Compound_9	N#Cc1ccccn1	0.604	0.295	0.544	0.561	0.181	0.152	0.067	0.93	0.942	0.849	0.885
Compound_10	c1ccc2c(c1)c1ccc3c4c1c(c2)ccc4ccc3	0.988	0.649	0.977	0.697	0.937	0.898	0.998	0.924	0.94	1.0	0.952
Compound_11	c1ccc2c(c1)c1cc3ccccc3c3c1c2ccc3	0.988	0.725	0.98	0.815	0.905	0.898	0.993	0.992	0.977	0.999	0.935
Compound_12	c1ccc2c(c1)cc1c(c2)c2c3c1cccc3ccc2	0.988	0.725	0.98	0.808	0.905	0.898	0.993	0.992	0.973	0.999	0.935
Compound_13	Nc1ccc2c(c1)cc1c(c2)cccc1	0.952	0.838	0.989	0.772	0.795	0.945	1.0	0.994	0.95	0.999	0.96
Compound_14	N=C1N=C(c2c1cc1ccccc1c2)N	0.847	0.749	0.861	0.578	0.037	0.524	0.249	0.988	0.934	0.874	0.882
Compound_15	S=c1sc2c([nH]1)cccc2	0.683	0.492	0.896	0.481	0.524	0.357	0.97	0.347	0.692	0.993	0.782
Compound_16	N#CSCSc1nc2c(s1)cccc2	0.952	0.588	0.746	0.583	0.55	0.682	0.996	0.873	0.95	0.983	0.918
Compound_17	Clc1nc2ccccc2nc1Cl	0.821	0.635	0.883	0.57	0.645	0.276	0.972	0.857	0.728	0.977	0.952
Compound_18	O=c1c2ccccc2c2c3c1cccc3[nH]n2	0.71	0.78	0.998	0.735	0.852	0.73	0.989	0.928	0.721	0.503	0.946
Compound_19	c1ccc2c(c1)c1cccc3c1c1c2cccc1cc3	0.988	0.649	0.977	0.622	0.937	0.898	0.998	0.924	0.931	1.0	0.952
Compound_20	Nc1ccc2c3c1cccc3c1c2cccc1	0.952	0.839	0.991	0.894	0.919	0.981	0.999	0.994	0.881	0.999	0.946
Compound_21	c1ccc2c(c1)cc1c(c2)ccc2c1cccc2	0.988	0.649	0.974	0.697	0.843	0.737	0.998	0.968	0.931	1.0	0.952
Compound_22	c1ccc2c(c1)ccc1c2cccn1	0.863	0.598	0.88	0.558	0.402	0.098	0.959	0.178	0.965	0.987	0.941
Compound_23	OC(=O)Cc1cccc2c1cccc2	0.05	0.294	0.335	0.352	0.153	0.098	0.997	0.111	0.058	0.303	0.317
Compound_24	[O-]C(=O)Cc1cccc2c1cccc2	0.32	0.478	0.748	0.425	0.109	0.06	0.998	0.804	0.078	0.732	0.951
Compound_25	OC(=O)c1c2ccccc2cc2c1cccc2	0.664	0.482	0.775	0.475	0.662	0.915	0.997	0.945	0.677	0.701	0.798
Compound_26	N#Cc1c2ccccc2cc2c1cccc2	0.992	0.681	0.939	0.671	0.905	0.343	0.998	0.987	0.89	0.998	0.991
Compound_27	Brc1c2ccccc2cc2c1cccc2	0.997	0.567	0.973	0.686	0.541	0.898	0.999	0.974	0.957	1.0	0.918
Compound_28	O=N(=O)c1c2ccccc2cc2c1cccc2	1.002	0.648	0.989	0.634	0.763	0.898	0.999	0.998	0.782	1.0	0.967
Compound_29	OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl	0.718	0.586	0.988	0.641	0.5	0.775	0.999	0.897	0.472	0.322	0.3
Compound_30	ClC(SN1C(=O)c2c(C1=O)cccc2)(Cl)Cl	0.721	0.642	0.635	0.635	0.482	0.898	0.987	0.994	0.219	0.969	0.918
Compound_31	OC(=O)Cn1c2ccccc2c(=O)c2c1cccc2	0.952	0.504	0.395	0.355	0.894	0.104	0.976	0.879	0.182	0.042	0.107
Compound_32	Oc1c(nc2c(c1Br)cccc2)C1C(=O)c2c(C1=O)cccc2	0.483	0.697	0.935	0.488	0.684	0.725	0.965	0.987	0.95	0.459	0.961
Compound_33	O=C1[N-]C(=O)c2c1cccc2	0.852	0.406	0.674	0.508	0.039	0.289	0.874	0.371	0.787	0.832	0.901
Compound_34	N=C1N=C(c2c1cccc2)N	0.755	0.733	0.481	0.557	0.01	0.213	0.153	0.802	0.877	0.347	0.762
Compound_35	O=Cc1c2ccccc2c(c2c1cccc2)Cl	0.965	0.593	0.816	0.663	0.809	0.802	0.999	0.974	0.686	0.999	0.991
Compound_36	Brc1c2ccccc2c(c2c1cccc2)Br	0.997	0.567	0.973	0.648	0.541	0.654	0.999	0.956	0.949	1.0	0.918
Compound_37	c1ccc(cc1)OP(Oc1ccccc1)Oc1ccccc1	0.952	0.635	0.741	0.663	0.924	0.098	0.999	0.652	0.969	0.99	0.677
Compound_38	C(Oc1ccccc1)COc1ccccc1	0.381	0.592	0.833	0.68	0.654	0.531	0.996	0.78	0.848	0.89	0.823
Compound_39	c1ccc(cc1)Oc1ccccc1	0.946	0.752	0.922	0.59	0.5	0.511	0.996	0.771	0.969	0.993	0.921
Compound_40	O=Cc1cccc(c1)Oc1ccccc1	0.771	0.754	0.536	0.569	0.392	0.729	0.992	0.283	0.566	0.84	0.921
Compound_41	Brc1ccc(cc1)Oc1ccccc1	0.981	0.765	0.861	0.69	0.624	0.639	0.997	0.873	0.687	0.997	0.981
Compound_42	O=C(Oc1ccccc1)Oc1ccccc1	0.866	0.72	0.833	0.688	0.566	0.446	0.992	0.762	0.907	0.646	0.163
Compound_43	ONc1ccccc1	0.961	0.495	0.926	0.66	0.115	0.79	0.982	0.845	0.879	0.972	0.513
Compound_44	NC(=O)NNc1ccccc1	0.597	0.367	0.79	0.328	0.093	0.098	0.883	0.045	0.521	0.071	0.235
Compound_45	NNc1ccccc1	0.779	0.404	0.926	0.66	0.168	0.685	0.984	0.845	0.829	0.834	0.313
Compound_46	O=Nc1ccc(cc1)Nc1ccccc1	0.976	0.674	0.989	0.638	0.385	0.876	0.996	0.987	0.95	1.0	0.979
Compound_47	Nc1ccc(cc1)Nc1ccccc1	0.965	0.736	0.943	0.676	0.447	0.821	0.997	0.99	0.955	0.991	0.97