Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)N(Cc1cnc2c(n1)c(N)nc(n2)N)C	0.505	0.512	0.078	0.148	0.521	0.098	0.054	0.93	0.386	0.641	0.918
Compound_2	OC(=O)CCC(C(=O)O)N	0.003	0.005	0.059	0.064	0.032	0.008	0.001	0.002	0.15	0.0	0.028
Compound_3	Nc1nc2nccnc2c(n1)N	0.524	0.839	0.572	0.498	0.392	0.297	0.015	0.377	0.959	0.925	0.901
Compound_4	O=Cc1cnc2c(n1)c(N)nc(n2)N	0.524	0.756	0.199	0.442	0.242	0.354	0.009	0.852	0.91	0.881	0.924
Compound_5	OCc1cnc2c(n1)c(N)nc(n2)N	0.41	0.637	0.037	0.371	0.244	0.25	0.008	0.709	0.68	0.208	0.945
Compound_6	Nc1nc(N)c2c(n1)ncc(n2)C(=O)O	0.256	0.727	0.088	0.379	0.281	0.28	0.017	0.379	0.763	0.426	0.792
Compound_7	OCc1nc2c(N)nc(nc2nc1O)N	0.646	0.553	0.052	0.348	0.57	0.613	0.035	0.701	0.68	0.027	0.834
Compound_8	CNc1ccc(cc1)C(=O)NC(C(=O)O)CCC(=O)O	0.065	0.372	0.135	0.099	0.102	0.103	0.006	0.018	0.379	0.005	0.026
Compound_9	OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(N)nc(n2)N	0.474	0.496	0.047	0.139	0.577	0.114	0.054	0.405	0.391	0.888	0.818
Compound_10	OC(=O)CCC(C(=O)O)NC(=O)c1ccc(c(c1)O)N(Cc1cnc2c(n1)c(N)nc(n2)N)C	0.53	0.435	0.01	0.196	0.65	0.344	0.158	0.816	0.38	0.197	0.779
Compound_11	OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1O)N(Cc1cnc2c(n1)c(N)nc(n2)N)C	0.595	0.442	0.081	0.239	0.692	0.336	0.187	0.879	0.37	0.156	0.776
Compound_12	NC(Cc1cc(F)c(cc1F)F)CC(=O)N1CCn2c(C1)nnc2C(F)(F)F	0.315	0.659	0.207	0.614	0.151	0.696	0.205	0.941	0.44	0.057	0.106
Compound_13	FC(c1nnc2n1CCNC2)(F)F	0.112	0.43	0.26	0.414	0.081	0.191	0.045	0.011	0.404	0.003	0.117
Compound_14	O=CN1CCn2c(C1)nnc2C(F)(F)F	0.175	0.544	0.183	0.638	0.076	0.362	0.072	0.977	0.566	0.007	0.175
Compound_15	NC(CC(=O)O)Cc1cc(F)c(cc1F)F	0.049	0.287	0.048	0.366	0.033	0.022	0.379	0.35	0.331	0.001	0.039
Compound_16	OCc1cc(ccc1O)C(CNC(C)(C)C)O	0.011	0.382	0.002	0.036	0.014	0.106	0.001	0.007	0.074	0.004	0.023
Compound_17	O=Cc1ccccc1O	0.797	0.217	0.474	0.666	0.116	0.251	0.836	0.52	0.784	0.633	0.468
Compound_18	OC(=O)CNC(C)(C)C	0.007	0.023	0.01	0.123	0.021	-0.0	0.0	0.004	0.09	0.0	0.065
Compound_19	O=Cc1cc(ccc1O)C(=O)O	0.247	0.158	0.055	0.432	0.281	0.803	0.679	0.805	0.754	0.112	0.237
Compound_20	O=C(c1ccc(c(c1)O)O)CNC(C)(C)C	0.177	0.279	0.023	0.276	0.117	0.184	0.001	0.399	0.213	0.001	0.065
Compound_21	OCc1cc(ccc1O)C(=O)CNC(C)(C)C	0.023	0.395	0.006	0.264	0.034	0.675	0.003	0.092	0.177	0.001	0.045