Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CN(Cc1ccccc1)C	0.352	0.205	0.089	0.163	0.005	0.24	0.009	0.779	0.567	0.503	0.018
Compound_2	O=Nc1ccc(cc1)N(C)C	0.958	0.405	0.99	0.578	0.11	0.643	0.984	0.96	0.95	0.997	0.918
Compound_3	CN(c1ccc(cc1)N(C)C)C	0.967	0.402	0.919	0.539	0.148	0.603	0.77	0.94	0.958	0.919	0.521
Compound_4	CN(c1ccc(cc1)Cc1ccc(cc1)N(C)C)C	0.919	0.673	0.919	0.525	0.616	0.963	0.984	0.686	0.877	0.971	0.847
Compound_5	O=Cc1ccc(cc1)N(C)C	0.896	0.433	0.723	0.539	0.088	0.876	0.922	0.254	0.957	0.651	0.641
Compound_6	CN(c1ccc(cc1)C(=O)c1ccc(cc1)N(C)C)C	0.975	0.72	0.895	0.662	0.333	0.965	0.981	0.375	0.95	0.861	0.906
Compound_7	C[N+](=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccccc2)C=C1)C	0.959	0.702	0.838	0.752	0.876	0.984	0.995	0.935	0.975	0.987	0.974
Compound_8	C[N+](=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccc(cc2)N(C)C)C=C1)C	0.963	0.702	0.851	0.771	0.876	0.984	0.995	0.926	0.971	0.987	0.974
Compound_9	[O-]C(=O)CCc1c(I)cc(c(c1I)N=CN(C)C)I	0.461	0.561	0.188	0.529	0.28	0.111	0.974	0.249	0.263	0.07	0.279
Compound_10	CN(C(=S)SSC(=S)N(C)C)C	0.567	0.114	0.068	0.478	0.341	0.898	0.189	0.859	0.96	1.0	0.649
Compound_11	CN(C(=S)SC(=S)N(C)C)C	0.427	0.095	0.107	0.48	0.109	0.657	0.194	0.806	0.96	0.999	0.577
Compound_12	CN(C(=S)[S-])C	0.433	0.103	0.272	0.568	0.113	0.898	0.306	0.972	0.964	0.999	0.821
Compound_13	CN(C(=S)[S-])C	0.433	0.103	0.272	0.568	0.113	0.898	0.306	0.972	0.964	0.999	0.821
Compound_14	CN(C(=S)[S-])C	0.433	0.103	0.272	0.568	0.113	0.898	0.306	0.972	0.964	0.999	0.821
Compound_15	CN(C(=O)Nc1ccccc1)C	0.921	0.204	0.871	0.606	0.163	0.158	0.249	0.419	0.662	0.278	0.065
Compound_16	CN([C@@H]1C(=O)C(=C([C@@]2([C@H]1C[C@@H]1Cc3c(C(=C1C2=O)O)c(O)ccc3N(C)C)O)O)C(=O)N)C	0.536	0.718	0.005	0.127	0.451	0.618	0.038	0.045	0.275	0.032	0.175
Compound_17	Cl[Yb](Cl)Cl	0.96	0.18	0.324	0.575	0.73	0.061	0.892	0.983	0.978	1.0	0.702
Compound_18	Cl[Sb](Cl)Cl	0.96	0.293	0.324	0.575	0.73	0.898	0.892	0.983	0.978	1.0	0.754
Compound_19	Cl[Nd](Cl)Cl	0.945	0.18	0.324	0.575	0.73	0.061	0.892	0.983	0.978	1.0	0.702
Compound_20	Cl[In](Cl)Cl	0.948	0.17	0.324	0.575	0.73	0.061	0.892	0.983	0.978	1.0	0.631
Compound_21	Cl[Hg]Cl	0.963	0.216	0.518	0.607	0.949	0.457	0.892	0.983	0.978	1.0	0.907
Compound_22	Cl[Fe]Cl	0.947	0.167	0.518	0.607	0.73	0.111	0.892	0.983	0.978	1.0	0.615
Compound_23	Cl[Dy](Cl)Cl	0.934	0.18	0.324	0.575	0.73	0.061	0.892	0.983	0.978	1.0	0.702
Compound_24	Cl[Cd]Cl	0.953	0.216	0.518	0.607	0.919	0.894	0.892	0.983	0.978	1.0	0.907
Compound_25	CC(=O)OC[C@H]1O[C@@H]([S-])[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C	0.91	0.496	0.573	0.665	0.298	0.148	0.981	0.195	0.943	0.01	0.922