Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CC1OC1P(=O)(O)O	0.442	0.292	0.061	0.295	0.602	0.316	0.978	0.015	0.489	0.851	0.249
Compound_2	Clc1ccccc1C(n1cncc1)(c1ccccc1)c1ccccc1	0.952	0.686	0.762	0.824	0.865	0.963	0.955	0.905	0.634	0.964	0.918
Compound_3	O=C1CCC(C23C1C(C)(C)C(C3)CC2)(C)C	0.979	0.801	0.171	0.383	0.272	0.132	0.021	0.032	0.252	0.998	0.682
Compound_4	OC(=O)C1N=C(c2ccccc2)c2c(NC1=O)ccc(c2)Cl	0.713	0.707	0.601	0.528	0.73	0.748	0.913	0.412	0.542	0.414	0.826
Compound_5	CC(=O)c1oc2c(c1C)cccc2	0.169	0.376	0.942	0.532	-0.0	0.075	0.76	0.878	0.756	0.912	0.867
Compound_6	C=CC(=CC(=O)CC(C)C)C	0.883	0.055	0.848	0.679	0.139	0.023	0.344	0.997	0.613	0.998	0.954
Compound_7	O=C1Nc2ccc(cc2C2(N(C1)CCO2)c1ccccc1Cl)Cl	0.495	0.709	0.852	0.315	0.729	0.822	0.203	0.248	0.461	0.558	0.666
Compound_8	CN1CCN2C(C1)c1ccccc1Cc1c2cccc1	0.199	0.738	0.082	0.051	0.493	0.444	0.009	0.012	0.501	0.013	0.115
Compound_9	CCCCC1OC(C)CC(=C1)C	0.929	0.243	0.149	0.587	0.236	0.168	0.655	0.885	0.726	0.993	0.836
Compound_10	COc1c(CC=C(CCC(=O)O)C)c(O)c2c(c1C)COC2=O	0.716	0.712	0.884	0.476	0.855	0.93	0.993	0.919	0.361	0.927	0.964
Compound_11	CC(=O)c1nccs1	0.481	0.481	0.466	0.476	0.163	0.53	0.834	0.863	0.923	0.569	0.725
Compound_12	CN1CC(c2ccccc2)c2c(C1)c(N)ccc2	0.098	0.759	0.378	0.12	0.121	0.334	0.199	0.064	0.488	0.682	0.286
Compound_13	CC=C(C(=O)OCCC(CCC=C(C)C)C)C	0.969	0.021	0.455	0.713	0.401	0.084	0.966	0.982	0.858	0.999	0.94
Compound_14	CCCCCC1C(CCC1=O)CC(=O)OC	0.881	0.359	0.162	0.513	0.006	0.017	0.636	0.812	0.33	0.947	0.794
Compound_15	COc1ccc(c(c1)C(C)(C)C)O	0.765	0.112	0.823	0.674	0.614	0.117	0.08	0.218	0.758	0.914	0.652
Compound_16	Cc1onc(c1)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NN1CCCCCC1	0.079	0.308	0.046	0.091	0.582	0.596	0.138	0.115	0.058	0.008	0.258
Compound_17	C=CCC1CN(C)CCC1(OC(=O)CC)c1ccccc1	0.117	0.5	0.069	0.168	0.03	0.037	0.001	0.679	0.157	0.057	0.2
Compound_18	NC(=O)OCC(c1ccccc1)COC(=O)N	0.21	0.211	0.137	0.275	0.042	0.153	0.03	0.004	0.058	0.023	0.262
Compound_19	O=C(c1ccccc1O)OC1CCCCC1	0.696	0.425	0.053	0.604	0.618	0.445	0.903	0.214	0.132	0.919	0.479
Compound_20	CCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCC	0.966	0.108	0.591	0.596	0.09	0.108	0.993	0.27	0.731	0.995	0.825
Compound_21	Cc1ccc(c(c1)OCCCC(C(=O)O)(C)C)C	0.053	0.281	0.32	0.239	0.5	0.183	0.011	0.48	0.355	0.049	0.066
Compound_22	Cc1cc(nnc1NCCN1CCOCC1)c1ccccc1	0.053	0.642	0.079	0.705	0.121	0.601	0.003	0.046	0.412	0.014	0.169
Compound_23	O=C1CC2(C)CCCC(C32C(C1C)C3)(C)C	0.979	0.569	0.086	0.444	0.351	0.114	0.209	0.161	0.406	0.999	0.487
Compound_24	CCC(c1cc(n2nc3c(n2)cccc3)c(c(c1)C(CC)(C)C)O)(C)C	0.342	0.724	0.58	0.64	0.285	0.901	0.563	0.142	0.714	0.928	0.79
Compound_25	OC(=O)Cc1ccc(n1C)C(=O)c1ccc(cc1)C	0.159	0.518	0.024	0.274	0.265	0.389	0.254	0.027	0.384	0.0	0.118
Compound_26	CC(CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C)C	0.966	0.085	0.925	0.581	0.104	0.098	0.987	0.038	0.354	0.979	0.645
Compound_27	O=C(C(c1ccc(cc1)O)N)NC1C(=O)N2C1SC(C2C(=O)O)(C)C	0.053	0.211	0.0	0.064	0.272	0.08	0.006	0.111	0.069	0.011	0.079
Compound_28	CC1Cc2c(N1NC(=O)c1ccc(c(c1)S(=O)(=O)N)Cl)cccc2	0.294	0.521	0.26	0.24	0.538	0.656	0.952	0.027	0.4	0.069	0.272
Compound_29	OC(COc1nsnc1N1CCOCC1)CNC(C)(C)C	0.053	0.659	0.026	0.142	0.072	0.098	0.001	0.008	0.337	0.142	0.374
Compound_30	OCC1CC2CC1C1C2C(CC1)CO	0.928	0.26	0.053	0.342	0.568	0.788	0.162	0.128	0.277	0.321	0.392
Compound_31	COc1cccc(c1)C1(O)CCCCC1CN(C)C	0.186	0.496	0.009	0.191	0.201	0.171	0.023	0.037	0.059	0.003	0.154
Compound_32	CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C	0.071	0.444	0.041	0.187	0.015	0.018	0.003	0.011	0.058	0.453	0.016
Compound_33	OS(=O)(=O)c1ccc2c(c1)[nH]c(n2)c1ccccc1	0.465	0.456	0.912	0.527	0.659	0.661	0.193	0.184	0.374	0.095	0.308
Compound_34	CC(CCCCCOC(=O)c1ccccc1C(=O)OCCCCCC(C)C)C	0.956	0.085	0.925	0.581	0.104	0.098	0.987	0.038	0.344	0.979	0.645
Compound_35	O=C(c1ccccc1C(=O)OC1(C)CCCCC1)OC1(C)CCCCC1	0.958	0.572	0.104	0.555	0.5	0.41	0.997	0.539	0.445	0.939	0.788
Compound_36	OCCNC(=O)c1c(I)c(NC(=O)C)c(c(c1I)C(=O)O)I	0.048	0.565	0.017	0.214	0.067	0.219	0.002	0.013	0.258	0.025	0.207
Compound_37	CCC(=CCC1CC=C(C1(C)C)C)CO	0.918	0.383	0.096	0.542	0.536	0.122	0.169	0.52	0.41	0.828	0.964
Compound_38	CCCCNc1cc(cc(c1Oc1ccccc1)S(=O)(=O)N)C(=O)O	0.06	0.426	0.046	0.213	0.46	0.609	0.004	0.005	0.363	0.005	0.091
Compound_39	CC(CCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCC(C)C)C	0.964	0.085	0.925	0.581	0.104	0.098	0.987	0.038	0.354	0.979	0.645
Compound_40	CCn1nc(C(=O)O)c(=O)c2c1cc1OCOc1c2	0.526	0.644	0.115	0.173	0.158	0.499	0.455	0.064	0.288	0.081	0.097
Compound_41	O=C1Cc2ccccc2N(c2c1cccc2)C(=O)N	0.202	0.319	0.274	0.198	0.753	0.098	0.963	0.008	0.393	0.024	0.212
Compound_42	N#CC(c1ccccc1)(c1ccccc1)CCN1CCC(CC1)(C(=O)O)c1ccccc1	0.139	0.526	0.037	0.119	0.875	0.22	0.506	0.03	0.301	0.002	0.656
Compound_43	CN1CCN(CC1)CC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2	0.053	0.663	0.155	0.096	0.286	0.312	0.007	0.036	0.426	0.465	0.141
Compound_44	NNC(C(=O)O)(Cc1ccc(c(c1)O)O)C	0.186	0.106	0.072	0.327	0.194	0.494	0.326	0.272	0.301	0.002	0.087
Compound_45	Clc1ccc2c(c1)C(=NCc1n2c(C)nn1)c1ccccc1Cl	0.738	0.79	0.748	0.794	0.574	0.898	0.916	0.238	0.917	0.027	0.45
Compound_46	Clc1ccc2c(c1)C(=NCc1n2c(C)nn1)c1ccccc1	0.706	0.803	0.288	0.735	0.553	0.898	0.93	0.156	0.95	0.031	0.486
Compound_47	O=C(Cc1c(Cl)cccc1Cl)N=C(N)N	0.092	0.384	0.461	0.564	0.174	0.368	0.956	0.187	0.15	0.026	0.267
Compound_48	OC(COc1ccc(cc1)CC(=O)N)CNC(C)C	0.002	0.312	0.006	0.162	0.015	0.088	0.001	0.002	0.131	0.0	0.0
Compound_49	CCOC(=O)C1N=C(c2c(NC1=O)ccc(c2)Cl)c1ccccc1F	0.696	0.695	0.988	0.672	0.766	0.772	0.812	0.886	0.458	0.199	0.68