Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CCCCCCCCCCCCN(CCC(=O)[O-])CCC(=O)[O-]	0.763	0.19	0.017	0.109	0.062	0.331	0.93	0.296	0.403	0.823	0.816
Compound_2	CCCCCCCCCCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCCCCCCCCCC)(C)C	0.095	0.294	0.039	0.732	0.106	0.08	0.911	0.05	0.23	0.03	0.279
Compound_3	CCCCCCCCCCCCCCN(CCC(=O)[O-])CCC(=O)[O-]	0.763	0.19	0.017	0.109	0.062	0.331	0.93	0.296	0.403	0.823	0.816
Compound_4	CCCCCCCCCCCCCC(=O)NCCC[N+](CC(CS(=O)(=O)[O-])O)(C)C	0.084	0.285	0.0	0.285	0.018	0.263	0.008	0.522	0.401	0.131	0.441
Compound_5	CCCCCCCCCCCCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCCCCCCCCCCCC)(C)C	0.095	0.294	0.039	0.732	0.106	0.08	0.911	0.05	0.23	0.03	0.279
Compound_6	CCCCCCCCCCCC[N+](CC(CS(=O)(=O)[O-])O)(C)C	0.353	0.39	0.004	0.472	0.051	0.537	0.254	0.297	0.394	0.42	0.454
Compound_7	CCCCCCCCCCCCCC[N+](CC(CS(=O)(=O)[O-])O)(C)C	0.353	0.39	0.004	0.472	0.051	0.537	0.254	0.297	0.394	0.42	0.454
Compound_8	CCCCCCCCCCCC[N+](CC(=O)[O-])(C)C	0.706	0.389	0.009	0.401	0.134	0.098	0.977	0.645	0.441	0.032	0.194
Compound_9	CCCCCCCCCCCCCC[N+](CC(=O)[O-])(C)C	0.706	0.389	0.009	0.401	0.134	0.098	0.977	0.645	0.441	0.032	0.194
Compound_10	CCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.062	0.006	0.992	0.777	0.146	0.998	0.915
Compound_11	CCCCCCCC=CCCCCCCCCC(=O)O	0.936	0.019	0.142	0.094	0.467	0.049	0.996	0.101	0.075	0.98	0.253
Compound_12	CCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.062	0.006	0.992	0.777	0.146	0.998	0.915
Compound_13	CCCCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.089	0.01	0.998	0.777	0.146	0.998	0.915
Compound_14	CCCCCCCC/C=C\CCCCCCCC(=O)[O-]	0.984	0.022	0.073	0.346	0.375	0.028	0.999	0.811	0.233	1.0	0.94
Compound_15	CCCCCCCCCCCCOC1OC(O)C(C(C(C1COC(=O)C(CC(=O)O)(CC(=O)[O-])O)O)O)O	0.398	0.381	0.003	0.404	0.555	0.349	0.851	0.867	0.598	0.765	0.721
Compound_16	CCCCCCCCCCCCCCOC1OC(O)C(C(C(C1COC(=O)C(CC(=O)O)(CC(=O)[O-])O)O)O)O	0.398	0.381	0.003	0.404	0.555	0.349	0.851	0.867	0.598	0.765	0.721
Compound_17	CCCCCCCCCCC(=O)NC(C(=O)[O-])CCC(=O)[O-]	0.189	0.033	0.02	0.269	0.062	0.023	0.034	0.275	0.343	0.875	0.118
Compound_18	CCCCCCCC(=O)[O-]	0.946	0.017	0.103	0.367	0.049	0.006	0.999	0.777	0.24	0.998	0.915
Compound_19	CCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.062	0.006	0.992	0.777	0.146	0.998	0.915
Compound_20	CCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.062	0.006	0.992	0.777	0.146	0.998	0.915
Compound_21	CCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.062	0.006	0.992	0.777	0.146	0.998	0.915
Compound_22	CCCCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.089	0.01	0.998	0.777	0.146	0.998	0.915
Compound_23	CCCCCCCC=CCCCCCCCC(=O)[O-]	0.984	0.022	0.073	0.346	0.392	0.01	0.998	0.811	0.18	1.0	0.94
Compound_24	CCCCCCCCCCCCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCCCCCCCCCCCC)(C)C	0.095	0.294	0.039	0.732	0.106	0.08	0.911	0.05	0.23	0.03	0.279
Compound_25	CCCCCCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.081	0.024	0.999	0.777	0.146	0.998	0.915
Compound_26	CCCCCC=CCCCC=CCCCCCC(=O)[O-]	0.945	0.022	0.073	0.346	0.327	0.006	0.997	0.811	0.137	1.0	0.94
Compound_27	CCCCCCCCCCCCC(=O)NC(C(=O)[O-])CCC(=O)[O-]	0.189	0.033	0.02	0.269	0.062	0.023	0.034	0.275	0.343	0.875	0.118
Compound_28	CCCCCCCCCCCCCCCC(=O)NCCC[N+](CC(CS(=O)(=O)[O-])O)(C)C	0.084	0.285	0.0	0.285	0.018	0.263	0.008	0.522	0.401	0.131	0.441
Compound_29	CCCCCCCCCCC(=O)NC(C(=O)[O-])CCC(=O)O	0.072	0.043	0.022	0.139	0.077	0.026	0.026	0.073	0.341	0.211	0.094
Compound_30	CCCCCCCCCCCCC(=O)NC(C(=O)[O-])CCC(=O)O	0.072	0.043	0.022	0.139	0.077	0.061	0.11	0.073	0.341	0.211	0.094
Compound_31	CCCCCCCCC=CCCCCCCCC(=O)[O-]	0.984	0.022	0.073	0.346	0.375	0.028	0.999	0.811	0.233	1.0	0.94
Compound_32	CCC=CCC=CCC=CCCCCCCCC(=O)[O-]	0.966	0.025	0.045	0.31	0.392	0.01	0.998	0.725	0.082	1.0	0.947
Compound_33	CCCCCCCCC=CCCCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCCCC=CCCCCCCCC)(C)C	0.391	0.273	0.094	0.749	0.378	0.116	0.939	0.747	0.269	0.305	0.333
Compound_34	CCCCCCCCCCCC(=O)OCCS(=O)(=O)[O-]	0.528	0.01	0.23	0.523	0.044	0.084	0.939	0.854	0.348	0.987	0.315
Compound_35	CCCCCCCCCCCCCC(=O)OCCS(=O)(=O)[O-]	0.528	0.01	0.23	0.523	0.06	0.111	0.936	0.854	0.348	0.987	0.315
Compound_36	CCCCCCCCCCCC(=O)NCCN(CC(=O)[O-])CCOCC(=O)[O-]	0.068	0.118	0.003	0.193	0.028	0.083	0.128	0.307	0.339	0.356	0.262
Compound_37	CCCCCCCCCCCCCC(=O)NCCN(CC(=O)[O-])CCOCC(=O)[O-]	0.068	0.118	0.003	0.193	0.028	0.083	0.128	0.307	0.339	0.356	0.262
Compound_38	CCCCCCCCCCCCCCCC(=O)NCCN(CC(=O)[O-])CCOCC(=O)[O-]	0.068	0.118	0.003	0.193	0.028	0.083	0.128	0.307	0.339	0.356	0.262
Compound_39	CCCCCCCC=CCCCCCCCC(=O)NCCN(CC(=O)[O-])CCOCC(=O)[O-]	0.264	0.168	0.004	0.215	0.075	0.168	0.157	0.663	0.341	0.614	0.296
Compound_40	CCCCCCCCCCCCCCCCCC(=O)[O-]	0.952	0.017	0.103	0.367	0.081	0.024	0.999	0.777	0.146	0.998	0.915
Compound_41	CCCCCCC(CCC)CO	0.928	0.041	0.07	0.566	0.063	0.041	0.923	0.11	0.595	0.826	0.666
Compound_42	CCCCCC(CO)CC	0.92	0.041	0.07	0.56	0.063	0.041	0.923	0.097	0.34	0.826	0.666
Compound_43	CCCCCCCCCCCCOCCS(=O)(=O)[O-]	0.656	0.065	0.132	0.472	0.056	0.196	0.96	0.934	0.421	0.983	0.321
Compound_44	CCCCCCCCCCCCCCCCOCCS(=O)(=O)[O-]	0.656	0.065	0.132	0.472	0.07	0.398	0.965	0.934	0.421	0.983	0.321
Compound_45	CCCCCCCCOCCS(=O)(=O)[O-]	0.638	0.065	0.132	0.472	0.056	0.196	0.96	0.934	0.421	0.983	0.321
Compound_46	CCCCCCCCCCOCCS(=O)(=O)[O-]	0.656	0.065	0.132	0.472	0.056	0.196	0.96	0.934	0.421	0.983	0.321
Compound_47	CCCCCCCCCCOOC(=O)CC(S(=O)(=O)[O-])C(=O)[O-]	0.844	0.03	0.142	0.484	0.121	0.21	0.949	0.962	0.416	0.839	0.309
Compound_48	CCCCCCCCCCCCOOC(=O)CC(S(=O)(=O)[O-])C(=O)[O-]	0.844	0.03	0.142	0.484	0.149	0.231	0.925	0.962	0.416	0.839	0.309
Compound_49	CCCCCCCCCCCCOCC(=O)O	0.816	0.091	0.028	0.335	0.085	0.148	0.976	0.361	0.34	0.877	0.404
Compound_50	CCCCCCCCCCCCCOCC(=O)O	0.816	0.091	0.028	0.335	0.085	0.148	0.976	0.361	0.34	0.877	0.404
Compound_51	CCCCCCCCCCCCCCOCC(=O)O	0.816	0.091	0.028	0.335	0.11	0.393	0.999	0.361	0.34	0.877	0.404
Compound_52	CCCCCCCCCCC(COCCCCCCCC)O	0.863	0.152	0.037	0.559	0.206	0.572	0.977	0.492	0.623	0.957	0.539
Compound_53	CCCCCCCCCCOCC(CCCCCCCCCC)O	0.863	0.152	0.037	0.559	0.206	0.572	0.977	0.492	0.623	0.957	0.539
Compound_54	CCCCCCCCCCCCCCCC(=O)OCCS(=O)(=O)[O-]	0.528	0.01	0.23	0.523	0.058	0.179	0.961	0.854	0.348	0.987	0.315
Compound_55	CCCCCCCCCCCCCCCC[N+](CCO)(CCO)C	0.544	0.307	0.01	0.568	0.063	0.723	0.727	0.344	0.936	0.002	0.205
Compound_56	CCCCCCCCCCCC[N+](CCO)(CCO)C	0.544	0.307	0.01	0.568	0.063	0.723	0.727	0.344	0.936	0.002	0.205