Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.952	0.671	0.071	0.635	0.909	0.575	0.995	0.918	0.594	0.992	0.943
Compound_2	CC(CCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.956	0.634	0.585	0.665	0.911	0.511	0.994	0.984	0.459	0.947	0.811
Compound_3	CCCC(c1ccccc1)C(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.896	0.671	0.016	0.626	0.918	0.461	0.995	0.969	0.511	0.992	0.943
Compound_4	CCCCCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.961	0.688	0.143	0.72	0.91	0.513	0.995	0.991	0.627	0.993	0.949
Compound_5	CCCCCC(OC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.959	0.612	0.059	0.541	0.9	0.511	0.977	0.871	0.569	0.991	0.923
Compound_6	CCCCC(COC(=O)C(=C(c1ccc(cc1)OC)c1ccccc1)C#N)CC	0.894	0.678	0.131	0.693	0.957	0.847	0.964	0.515	0.599	0.953	0.925
Compound_7	CCCCCCCCCCCCCCCCOC(=O)C(=Cc1ccc(cc1)C)C#N	0.975	0.349	0.183	0.767	0.745	0.482	0.999	0.994	0.572	0.991	0.924
Compound_8	CCCCCCOC(=O)[C](=C(c1ccccc1)c1ccccc1)(C#N)CC	0.909	0.71	0.183	0.767	0.932	0.562	0.998	0.994	0.547	0.913	0.95
Compound_9	CCCCC(COC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CC	0.894	0.678	0.131	0.693	0.957	0.847	0.964	0.515	0.599	0.953	0.925
Compound_10	CCCCC(c1ccccc1)(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.87	0.694	0.277	0.729	0.936	0.62	0.975	0.995	0.547	0.915	0.95
Compound_11	CCCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.947	0.688	0.143	0.72	0.907	0.578	0.997	0.991	0.557	0.993	0.949
Compound_12	CC(OC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CCCCCC(C)C	0.964	0.616	0.346	0.519	0.905	0.444	0.977	0.915	0.441	0.986	0.76
Compound_13	CCCC(c1ccccc1)CC(OC(=O)/C(=C/c1ccccc1)/C#N)CC	0.932	0.612	0.096	0.504	0.913	0.401	0.978	0.919	0.499	0.991	0.923
Compound_14	CCCCCCCCOC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N	0.91	0.672	0.22	0.756	0.956	0.836	0.956	0.881	0.627	0.874	0.917
Compound_15	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CCCC	0.962	0.657	0.071	0.646	0.909	0.575	0.995	0.931	0.598	0.993	0.941
Compound_16	CCCC(c1ccccc1)C(COC(=O)C(=Cc1ccccc1)C#N)CC	0.896	0.671	0.016	0.626	0.918	0.461	0.995	0.969	0.511	0.992	0.943
Compound_17	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)F)/c1ccccc1)/C#N)CC	0.958	0.591	0.139	0.632	0.916	0.517	0.995	0.95	0.616	0.992	0.847
Compound_18	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)c1ccccc1)/c1ccccc1)/C#N)CC	0.962	0.671	0.177	0.773	0.975	0.808	0.998	0.906	0.483	0.965	0.945
Compound_19	CCCCC(c1ccccc1)(COC(=O)[C](=C)(c1ccccc1)C#N)CC	0.878	0.664	0.177	0.773	0.924	0.482	0.976	0.906	0.56	0.933	0.938
Compound_20	CCCCCCOC(=O)/C(=C(\c1ccccc1CC)/c1ccccc1)/C#N	0.779	0.623	0.243	0.754	0.897	0.389	0.997	0.991	0.555	0.982	0.949
Compound_21	CCCCCC(OC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CC	0.906	0.68	0.083	0.597	0.95	0.785	0.927	0.676	0.575	0.954	0.914
Compound_22	CCCCOC(=O)C(=[C](c1ccccc1)(OC)C)C#N	0.89	0.37	0.083	0.597	0.698	0.249	0.982	0.676	0.543	0.086	0.83
Compound_23	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)Cl)/c1ccccc1)/C#N)CC	0.93	0.598	0.139	0.632	0.972	0.782	0.92	0.95	0.556	0.995	0.94
Compound_24	CCCCC(COC(=O)C(=C(c1ccc(cc1)C)c1ccc(cc1)C)C#N)CC	0.945	0.671	0.062	0.645	0.895	0.609	0.988	0.869	0.546	0.994	0.94
Compound_25	CCCC[C@@H](COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.952	0.671	0.071	0.635	0.909	0.575	0.995	0.918	0.594	0.992	0.943
Compound_26	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.952	0.671	0.071	0.635	0.909	0.575	0.995	0.918	0.594	0.992	0.943
Compound_27	CCCCCCCCCCCCCCCCOC(=O)/C(=C/c1ccc(cc1)C)/C#N	0.975	0.349	0.183	0.767	0.745	0.482	0.999	0.994	0.572	0.991	0.924
Compound_28	CCCCCCCCOC(=O)C(=C(c1ccc(cc1)OC)c1ccccc1)C#N	0.91	0.672	0.22	0.756	0.956	0.836	0.956	0.881	0.627	0.874	0.917
Compound_29	CCC(CCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.956	0.661	0.093	0.611	0.925	0.499	0.994	0.981	0.577	0.988	0.941
Compound_30	CCCCC(COC(=O)/C(=C(\c1ccc(c(c1)C)C)/c1ccc(cc1)OC)/C#N)CC	0.923	0.679	0.126	0.703	0.928	0.9	0.942	0.518	0.52	0.944	0.945
Compound_31	CCCCC(COC(=O)/C(=C(\c1ccc(c(c1)C)C)/c1ccccc1)/C#N)CC	0.952	0.67	0.068	0.639	0.856	0.461	0.977	0.889	0.521	0.99	0.946
Compound_32	CCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.928	0.756	0.143	0.715	0.92	0.6	0.998	0.982	0.549	0.619	0.92
Compound_33	CCCCCCOC(=O)/C(=C/c1ccc(cc1)OC)/C#N	0.929	0.452	0.315	0.815	0.842	0.609	0.958	0.929	0.557	0.908	0.893
Compound_34	CCCCCC(OC(=O)C(=C(c1ccccc1OC)c1ccccc1)C#N)CC	0.853	0.679	0.096	0.57	0.883	0.471	0.931	0.691	0.553	0.945	0.933
Compound_35	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.947	0.671	0.071	0.615	0.909	0.575	0.995	0.983	0.582	0.992	0.943
Compound_36	CCCCC(COC(=O)/C(=C/C=C/c1ccccc1)/C#N)CC	0.956	0.38	0.266	0.755	0.731	0.246	0.996	0.928	0.67	0.994	0.918
Compound_37	CCCCC(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.967	0.38	0.103	0.676	0.731	0.246	0.996	0.954	0.6	0.994	0.918
Compound_38	CCCCCCC(COC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CCCC	0.916	0.678	0.131	0.703	0.953	0.912	0.975	0.513	0.611	0.953	0.925
Compound_39	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.952	0.671	0.071	0.635	0.909	0.575	0.995	0.918	0.594	0.992	0.943