Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	OC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.69	0.014	0.218	0.664	0.37	0.017	0.948	0.924	0.163	0.354	0.918
Compound_2	OC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.7	0.014	0.248	0.79	0.353	0.018	0.899	0.899	0.132	0.354	0.918
Compound_3	OC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.795	0.014	0.248	0.812	0.318	0.023	0.86	0.873	0.1	0.354	0.918
Compound_4	OC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.833	0.014	0.248	0.812	0.316	0.021	0.928	0.873	0.091	0.354	0.918
Compound_5	OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.877	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_6	OC(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_7	OC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_8	OC(=O)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_9	OC(=O)C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_10	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_11	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.454	0.036	0.99	0.873	0.088	0.354	0.918
Compound_12	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.518	0.049	0.998	0.873	0.088	0.354	0.918
Compound_13	OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.887	0.014	0.248	0.812	0.518	0.049	0.998	0.873	0.088	0.354	0.918
Compound_14	FC(C(C(S(=O)(=O)O)(F)F)(F)F)(C(F)(F)F)F	0.702	0.114	0.182	0.741	0.204	0.19	0.941	0.871	0.338	0.889	0.205
Compound_15	FC(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F	0.699	0.114	0.182	0.782	0.215	0.2	0.941	0.839	0.337	0.889	0.205
Compound_16	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.703	0.114	0.182	0.782	0.225	0.216	0.96	0.839	0.335	0.889	0.205
Compound_17	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.746	0.114	0.182	0.782	0.232	0.219	0.975	0.839	0.335	0.889	0.205
Compound_18	FC(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.746	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_19	FC(C(C(C(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.76	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_20	FC(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.76	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_21	FC(C(C(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.76	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_22	FC(C(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.76	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_23	OC(=O)CCC(C(C(F)(F)F)(F)F)(F)F	0.689	0.025	0.408	0.571	0.293	0.024	0.86	0.512	0.034	0.043	0.416
Compound_24	OC(=O)CCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.874	0.025	0.408	0.602	0.446	0.04	0.99	0.461	0.028	0.043	0.416
Compound_25	OC(=O)CCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.886	0.025	0.408	0.602	0.446	0.04	0.99	0.461	0.028	0.043	0.416
Compound_26	FC(C(C(C(F)(F)F)(F)F)(F)F)(CCS(=O)(=O)O)F	0.741	0.081	0.199	0.661	0.275	0.224	0.96	0.519	0.346	0.374	0.273
Compound_27	OS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.837	0.081	0.199	0.661	0.395	0.264	0.986	0.519	0.346	0.374	0.273
Compound_28	OS(=O)(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.85	0.081	0.199	0.661	0.395	0.264	0.986	0.519	0.346	0.374	0.273
Compound_29	FC(C(C(C(C(C(C(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.76	0.114	0.182	0.782	0.321	0.251	0.988	0.839	0.336	0.889	0.205
Compound_30	OC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	0.745	0.053	0.481	0.579	0.318	0.068	0.851	0.93	0.256	0.317	0.92
Compound_31	OC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F	0.718	0.073	0.154	0.579	0.408	0.104	0.666	0.93	0.259	0.293	0.901
Compound_32	OC(=O)C(C(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)F)(F)F	0.854	0.021	0.528	0.599	0.444	0.099	0.19	0.99	0.32	0.435	0.912
Compound_33	OC(=O)C(C(OC(F)(F)F)(F)F)(F)F	0.727	0.021	0.128	0.501	0.451	0.028	0.449	0.998	0.347	0.463	0.933
Compound_34	OC(=O)C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F	0.647	0.031	0.624	0.506	0.299	0.074	0.043	0.994	0.356	0.251	0.899
Compound_35	OC(=O)C(C(C(OC(F)(F)F)(F)F)(F)F)(F)F	0.677	0.023	0.542	0.604	0.384	0.042	0.924	0.992	0.332	0.304	0.94
Compound_36	FC(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)S(=O)(=O)O)(C(F)(F)F)F	0.74	0.481	0.105	0.608	0.467	0.322	0.995	0.803	0.347	0.927	0.123
Compound_37	FC(C(F)(F)F)(OC(C(S(=O)(=O)O)(F)F)(F)F)F	0.495	0.131	0.625	0.586	0.188	0.213	0.302	0.972	0.35	0.522	0.23
Compound_38	FC(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(OC(C(S(=O)(=O)O)(F)F)(F)F)F	0.728	0.152	0.482	0.74	0.346	0.342	0.859	0.832	0.378	0.443	0.249
Compound_39	FC(C(C(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OC(C(S(=O)(=O)O)(F)F)(F)F)F	0.787	0.152	0.482	0.74	0.387	0.346	0.891	0.832	0.379	0.443	0.249
Compound_40	FC(C(C(S(=O)(=O)N)(F)F)(F)F)(C(F)(F)F)F	0.626	0.168	0.158	0.523	0.17	0.05	0.779	0.129	0.231	0.324	0.918
Compound_41	FC(C(C(C(C(C(S(=O)(=O)N)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.717	0.168	0.158	0.523	0.19	0.067	0.841	0.129	0.225	0.324	0.918
Compound_42	FC(C(C(C(C(S(=O)(=O)N)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.738	0.168	0.158	0.523	0.295	0.098	0.967	0.129	0.227	0.324	0.918
Compound_43	CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.464	0.182	0.547	0.617	0.25	0.098	0.56	0.893	0.222	0.963	0.907
Compound_44	CCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.284	0.221	0.617	0.695	0.19	0.099	0.377	0.886	0.284	0.474	0.799
Compound_45	OCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C	0.238	0.241	0.345	0.685	0.328	0.192	0.859	0.282	0.302	0.014	0.621
Compound_46	OCCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC	0.196	0.229	0.306	0.675	0.315	0.199	0.859	0.225	0.305	0.088	0.552
Compound_47	OC(=O)CN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C	0.317	0.212	0.05	0.587	0.451	0.061	0.806	0.931	0.347	0.093	0.662
Compound_48	CCN(S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC(=O)O	0.198	0.181	0.059	0.582	0.5	0.074	0.689	0.909	0.258	0.183	0.573
Compound_49	[O-]C(=O)C[N+](CCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C)C	0.193	0.378	0.01	0.52	0.412	0.059	0.122	0.825	0.384	0.041	0.548
Compound_50	O=S(=O)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)NCCCN(=O)(C)C	0.263	0.478	0.053	0.535	0.281	0.286	0.138	0.66	0.375	0.092	0.586
Compound_51	OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.959	0.078	0.329	0.631	0.401	0.12	0.984	0.116	0.035	0.412	0.875
Compound_52	CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	0.964	0.092	0.221	0.648	0.349	0.06	0.983	0.057	0.09	0.931	0.912
Compound_53	OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.964	0.078	0.329	0.631	0.401	0.12	0.984	0.116	0.035	0.412	0.875
Compound_54	FC(C(C(C(C(P(=O)(O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.81	0.147	0.117	0.473	0.669	0.143	0.99	0.095	0.164	0.642	0.557
Compound_55	FC(C(C(C(C(C(P(=O)(O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.821	0.147	0.117	0.473	0.669	0.143	0.99	0.095	0.164	0.642	0.557
Compound_56	OP(=O)(OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	0.983	0.089	0.117	0.514	0.444	0.126	0.973	0.109	0.097	0.068	0.353
Compound_57	OP(=O)(OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	0.985	0.089	0.117	0.514	0.444	0.126	0.973	0.109	0.097	0.068	0.353
Compound_58	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCOP(=O)(OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)F	0.955	0.136	0.12	0.521	0.572	0.166	0.985	0.109	0.217	0.72	0.431
Compound_59	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCOP(=O)(OCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)F	0.959	0.136	0.12	0.521	0.572	0.166	0.985	0.109	0.217	0.72	0.431
Compound_60	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(P(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)F	0.782	0.14	0.128	0.512	0.759	0.193	0.983	0.128	0.163	0.924	0.839
Compound_61	OS(=O)(=O)CCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.85	0.081	0.199	0.661	0.395	0.264	0.986	0.519	0.346	0.374	0.273
Compound_62	OC(=O)C(F)(F)F	0.68	0.014	0.047	0.438	0.337	0.017	0.38	0.998	0.372	0.354	0.918
Compound_63	FC(S(=O)(=O)O)(F)F	0.663	0.114	0.052	0.47	0.636	0.257	0.6	0.998	0.366	0.889	0.205
Compound_64	OC(=O)C(C(F)(F)F)(F)F	0.672	0.014	0.047	0.543	0.458	0.028	0.93	0.982	0.193	0.354	0.918
Compound_65	FC(S(=O)(=O)O)(C(F)(F)F)F	0.674	0.114	0.052	0.562	0.228	0.194	0.651	0.982	0.275	0.889	0.205
Compound_66	FC(C(C(S(=O)(=O)O)(F)F)(F)F)(F)F	0.705	0.114	0.159	0.641	0.247	0.207	0.938	0.925	0.32	0.889	0.205