Index	SMILES	AR	AR-LBD	AhR	Aromatase	ER	ER-LBD	PPAR-gamma	ARE	ATAD5	HSE	p53
Compound_1	COc1ccc(cc1)C(c1ccc(cc1)OC)(C)C	0.91	0.506	0.831	0.71	0.823	0.977	0.958	0.027	0.733	0.893	0.863
Compound_2	O=C/C=C(\C=C/C(=O)O)/CO	0.815	0.139	0.06	0.331	0.367	0.698	0.911	0.756	0.712	0.304	0.96
Compound_3	OC(=O)/C=C\C(=C/C(=O)O)\C	0.656	0.145	0.218	0.391	0.404	0.061	0.898	0.797	0.854	0.705	0.899
Compound_4	OC(=O)C/C(=C\C(=O)O)/C(c1cc(O)c(c(c1)O)O)(C)C	0.899	0.385	0.17	0.302	0.871	0.197	0.613	0.837	0.48	0.914	0.281
Compound_5	COC/C=C\C(=C/C(=O)O)\C(c1ccc(cc1)OC(=O)O)(C)C	0.779	0.33	0.566	0.414	0.882	0.934	0.958	0.948	0.678	0.827	0.367
Compound_6	O=C/C=C(/C(/C(=C/C(=O)O)/CC(=O)O)(C)C)\C=C/C(=O)O	0.678	0.12	0.234	0.271	0.5	0.66	0.632	0.921	0.286	0.38	0.765
Compound_7	OC(=O)/C=C(/C(c1ccc(cc1)O)(C)C)\C=C/C(=O)O	0.727	0.257	0.389	0.456	0.914	0.916	0.864	0.908	0.813	0.729	0.67
Compound_8	O=CC/C(=C\C(=O)O)/C(c1ccc(cc1)O)(C)C	0.757	0.306	0.138	0.392	0.749	0.899	0.693	0.674	0.675	0.558	0.554
Compound_9	COc1ccc(cc1)C(c1ccc(c(c1)O)OC(O)O)(C)C	0.879	0.46	0.396	0.643	0.828	0.606	0.839	0.375	0.294	0.684	0.22
Compound_10	COc1ccc(cc1)C(/C(=C/C(=O)O)/C=C\C(=O)O)(C)C	0.653	0.284	0.615	0.493	0.852	0.942	0.98	0.917	0.816	0.834	0.915
Compound_11	OCOc1ccc(cc1O)C(c1ccc(c(c1)O)OC)(C)C	0.879	0.47	0.396	0.59	0.828	0.606	0.839	0.76	0.195	0.659	0.763
Compound_12	OCOc1ccc(cc1O)C(c1ccc(cc1)OC)(C)C	0.879	0.47	0.396	0.64	0.828	0.606	0.839	0.737	0.241	0.659	0.763
Compound_13	O=COc1ccc(cc1O)C(c1ccc(cc1)OC)(C)C	0.938	0.488	0.764	0.686	0.898	0.376	0.833	0.149	0.367	0.214	0.582
Compound_14	OCOc1ccc(cc1)C(c1ccc(cc1)OC)(C)C	0.873	0.604	0.498	0.639	0.76	0.984	0.959	0.497	0.483	0.112	0.633
Compound_15	COc1ccc(cc1)C(c1ccc(c(c1)O)OC)(C)C	0.931	0.462	0.764	0.698	0.905	0.534	0.888	0.209	0.355	0.614	0.861
Compound_16	Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O	0.735	0.516	0.452	0.686	0.468	0.661	0.576	0.434	0.582	0.756	0.348
Compound_17	OC(=O)/C=C\C(=C/C(=O)O)\S(=O)(=O)O	0.544	0.188	0.226	0.302	0.375	0.216	0.775	0.902	0.497	0.844	0.141
Compound_18	OC(=O)/C=C(/S(=O)(=O)C1=CC(=O)C(=O)C=C1)\C=C/C(=O)O	0.411	0.436	0.064	0.485	0.608	0.459	0.807	0.418	0.429	0.882	0.224
Compound_19	C/C=C(/S(=O)(=O)c1ccc(cc1)O)\C(=O)O	0.494	0.424	0.238	0.323	0.385	0.423	0.241	0.489	0.432	0.965	0.155
Compound_20	OC(=O)C(CC(S(=O)(=O)c1ccc(c(c1)O)O)C)O	0.371	0.298	0.028	0.217	0.258	0.512	0.053	0.292	0.337	0.529	0.073
Compound_21	OCCCC(S(=O)(=O)c1ccc(c(c1)O)O)C(=O)O	0.395	0.368	0.014	0.244	0.448	0.54	0.11	0.076	0.387	0.107	0.114
Compound_22	O=C/C=C\C(=C)S(=O)(=O)c1ccc(cc1)O	0.639	0.445	0.866	0.71	0.392	0.676	0.524	0.998	0.447	0.868	0.286
Compound_23	O/C=C/C(=C\CC(=O)O)/S(=O)(=O)c1ccc(cc1)O	0.498	0.368	0.148	0.287	0.288	0.403	0.334	0.742	0.347	0.802	0.149
Compound_24	O=C/C=C(/S(=O)(=O)c1ccc(cc1)O)\C=O	0.563	0.484	0.843	0.708	0.392	0.676	0.524	0.988	0.429	0.767	0.233
Compound_25	Oc1ccc(cc1)S(=O)(=O)c1ccc(c(c1)O)O	0.755	0.484	0.542	0.667	0.598	0.613	0.459	0.932	0.24	0.969	0.418
Compound_26	Oc1ccc(cc1)Cc1ccc(cc1)O	0.899	0.784	0.69	0.635	0.889	0.972	0.99	0.918	0.791	0.598	0.842
Compound_27	C=C(Cc1ccc(cc1)O)/C=C\C(=O)O	0.788	0.4	0.215	0.468	0.814	0.852	0.974	0.943	0.865	0.3	0.42
Compound_28	C=C/C=C\C(=O)O	0.667	0.045	0.106	0.31	0.53	0.057	0.995	0.942	0.852	0.617	0.811
Compound_29	OC(=O)/C=C(\C(=O)O)/Cc1ccc(cc1)O	0.774	0.342	0.096	0.318	0.697	0.799	0.96	0.048	0.733	0.113	0.225
Compound_30	OCc1ccc(cc1)O	0.556	0.146	0.554	0.594	0.347	0.411	0.939	0.33	0.662	0.022	0.424
Compound_31	OC(=O)/C=C(/Cc1ccc(cc1)O)\C=C/C(=O)O	0.663	0.362	0.359	0.432	0.805	0.835	0.956	0.893	0.865	0.361	0.459
Compound_32	O=C/C=C(\C(=O)C=O)/CC1=CC(=O)C(=O)C=C1	0.83	0.382	0.562	0.648	0.216	0.843	0.984	0.962	0.501	0.982	0.873
Compound_33	O=C/C=C\C(=C/C(=O)O)\Cc1ccc(cc1)O	0.748	0.362	0.425	0.457	0.72	0.912	0.988	0.952	0.881	0.361	0.459
Compound_34	O=Cc1ccc(cc1)O	0.865	0.159	0.334	0.639	0.357	0.903	0.951	0.355	0.909	0.066	0.273
Compound_35	O/C=C/C=C(/Cc1ccc(cc1)O)\CC(=O)O	0.754	0.316	0.29	0.266	0.571	0.541	0.85	0.624	0.412	0.382	0.136
Compound_36	Oc1ccc(cc1)C(O)C	0.578	0.159	0.14	0.359	0.478	0.438	0.771	0.081	0.302	0.306	0.193
Compound_37	C/C=C\C(=C/C(=O)O)\CC1=CC(=O)C(=O)C=C1	0.456	0.419	0.237	0.486	0.506	0.334	0.901	0.854	0.436	0.844	0.089
Compound_38	C/C=C\C(=C/C=O)\CC1=CC(=O)C(=O)C=C1	0.855	0.39	0.556	0.619	0.212	0.721	0.95	0.942	0.619	0.989	0.747
Compound_39	CC(c1ccc(cc1)O)c1ccc(cc1)O	0.952	0.733	0.681	0.644	0.887	0.909	0.99	0.855	0.467	0.832	0.779
Compound_40	OC(=O)/C=C\C(=C/C(=O)O)\C(O)C	0.718	0.143	0.074	0.372	0.487	0.166	0.929	0.852	0.72	0.779	0.884
Compound_41	C=C/C=C\C(=O)O	0.667	0.045	0.106	0.31	0.53	0.057	0.995	0.942	0.852	0.617	0.811
Compound_42	OC/C=C(/Cc1ccc(cc1)O)\C=C/C=O	0.859	0.391	0.436	0.621	0.596	0.944	0.982	0.828	0.785	0.18	0.749
Compound_43	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C(=O)O	0.787	0.357	0.08	0.309	0.728	0.608	0.897	0.053	0.39	0.788	0.5
Compound_44	CC(=O)c1ccc(cc1)O	0.95	0.151	0.698	0.613	0.63	0.967	0.619	0.51	0.696	0.158	0.088
Compound_45	O=CC(c1ccc(cc1)O)/C(=C/C(=O)O)/C=C\C(=O)O	0.576	0.379	0.362	0.496	0.669	0.814	0.962	0.979	0.521	0.519	0.77
Compound_46	OC(=O)/C=C(/C(c1ccc(cc1)O)(O)C)\C=C/C(=O)O	0.692	0.332	0.26	0.485	0.855	0.499	0.888	0.772	0.716	0.81	0.673
Compound_47	O=C/C=C(/C(c1ccc(cc1)O)C=O)\C=O	0.749	0.401	0.814	0.704	0.589	0.854	0.983	0.996	0.579	0.573	0.893
Compound_48	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C=C(/C(=O)O)\O	0.623	0.311	0.205	0.421	0.67	0.479	0.909	0.792	0.376	0.745	0.382
Compound_49	Oc1ccc(cc1)C(O)C	0.578	0.159	0.14	0.359	0.478	0.438	0.771	0.081	0.302	0.306	0.193
Compound_50	OC(=O)/C=C(/C(c1ccc(cc1)O)C)\C=C/C(=O)O	0.68	0.357	0.32	0.486	0.824	0.653	0.909	0.938	0.555	0.788	0.5
Compound_51	O=CC(/C(=C/C)/C(=O)O)c1ccc(cc1)O	0.735	0.357	0.211	0.336	0.629	0.634	0.92	0.63	0.55	0.788	0.5
Compound_52	O=C/C=C(/C(c1ccc(cc1)O)C)\C=O	0.814	0.39	0.799	0.662	0.59	0.86	0.971	0.994	0.55	0.662	0.718
Compound_53	OC/C=C(/C(c1ccc(cc1)O)C)\C=C/C(=O)O	0.785	0.435	0.057	0.399	0.829	0.77	0.725	0.654	0.41	0.57	0.348
Compound_54	O=C/C=C(/C(c1ccc(cc1)O)C)\C(=O)O	0.823	0.357	0.199	0.373	0.636	0.732	0.932	0.63	0.426	0.788	0.5
Compound_55	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)C	0.97	0.708	0.754	0.63	0.936	0.336	0.964	0.991	0.636	0.966	0.449
Compound_56	O=C/C=C\C(=O)C(c1ccc(cc1)O)C	0.703	0.225	0.634	0.611	0.534	0.879	0.942	0.831	0.539	0.558	0.262
Compound_57	OC(c1ccc(c(c1)O)O)O	0.606	0.123	0.325	0.596	0.369	0.045	0.45	0.701	0.159	0.964	0.409
Compound_58	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)C	0.958	0.6	0.754	0.63	0.915	0.233	0.977	0.989	0.145	0.983	0.748
Compound_59	CCC(c1ccc(cc1)O)(c1ccc(cc1)O)C	0.951	0.82	0.502	0.646	0.967	0.99	0.969	0.949	0.535	0.794	0.918
Compound_60	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C)C)\C(=O)O	0.896	0.288	0.104	0.319	0.849	0.156	0.712	0.467	0.295	0.924	0.615
Compound_61	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C(O)C)C)\C(=O)O	0.713	0.33	0.023	0.345	0.838	0.109	0.179	0.275	0.232	0.922	0.728
Compound_62	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)(C(O)C)C	0.8	0.678	0.172	0.51	0.962	0.557	0.348	0.25	0.532	0.908	0.736
Compound_63	OCC(c1ccc(cc1)O)(c1ccc(cc1)O)C	0.716	0.756	0.323	0.568	0.927	0.982	0.964	0.531	0.339	0.329	0.72
Compound_64	CCC(c1ccc(cc1)O)(/C(=C/C(=O)O)/C=C\C(=O)O)C	0.748	0.324	0.229	0.454	0.944	0.946	0.939	0.902	0.674	0.791	0.592
Compound_65	O=C/C=C(/C(C1=CC(=O)C(=O)C=C1)(C(=O)C)C)\C=O	0.794	0.357	0.511	0.694	0.277	0.777	0.977	0.875	0.531	0.956	0.834
Compound_66	Oc1ccc(cc1O)C(C)(C)C	0.952	0.1	0.686	0.611	0.824	0.171	0.913	0.941	0.257	0.972	0.478
Compound_67	CCC(c1cc(O)c(c(c1)O)O)(c1ccc(c(c1)O)O)C	0.974	0.686	0.518	0.645	0.976	0.65	0.775	0.997	0.294	0.968	0.638
Compound_68	CCC(/C(=C/C=O)/C(=O)O)(c1ccc(cc1)O)C	0.806	0.354	0.18	0.352	0.775	0.911	0.771	0.688	0.511	0.615	0.432
Compound_69	CCC(c1ccc(c(c1)O)O)(c1ccc(cc1)O)C	0.963	0.626	0.592	0.632	0.972	0.613	0.78	0.992	0.225	0.974	0.852
Compound_70	CC(c1ccc(cc1)O)(c1ccc(cc1)O)C	0.976	0.629	0.722	0.637	0.948	0.983	0.981	0.957	0.711	0.747	0.875
Compound_71	OCC(c1cc(O)c(c(c1)O)O)(O)C	0.58	0.233	0.439	0.536	0.694	0.064	0.448	0.788	0.383	0.737	0.114
Compound_72	Oc1ccc(cc1O)C(c1cc(O)c(c(c1)O)O)(C)C	0.985	0.62	0.735	0.657	0.965	0.578	0.826	0.999	0.302	0.904	0.579
Compound_73	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)(O)C	0.859	0.565	0.539	0.57	0.91	0.102	0.849	0.395	0.187	0.986	0.91
Compound_74	Oc1ccc(cc1O)C(O)(C)C	0.747	0.138	0.361	0.639	0.764	0.035	0.89	0.654	0.157	0.894	0.304
Compound_75	OC(=O)/C=C(/C(c1ccc(c(c1)O)O)(C)C)\C=C/C(=O)O	0.769	0.288	0.368	0.448	0.931	0.226	0.512	0.957	0.299	0.924	0.615
Compound_76	OC(=O)/C=C(/C(c1ccc(cc1)O)(C)C)\C=C/C(=O)O	0.727	0.257	0.389	0.456	0.914	0.916	0.864	0.908	0.813	0.729	0.67
Compound_77	CC(c1ccc(c(c1)O)O)C	0.902	0.107	0.615	0.583	0.761	0.076	0.955	0.988	0.138	0.96	0.232
Compound_78	Oc1ccc(cc1)C(c1cc(O)c(c(c1)O)O)(O)C	0.888	0.657	0.539	0.58	0.932	0.242	0.923	0.436	0.759	0.952	0.736
Compound_79	Oc1ccc(cc1)C(=O)c1cc(O)c(c(c1)O)O	0.963	0.761	0.817	0.766	0.964	0.815	0.968	0.962	0.93	0.953	0.658
Compound_80	O=C/C=C(/C(c1ccc(cc1)O)(C)C)\C=C(/C(=O)O)\O	0.738	0.241	0.146	0.336	0.725	0.88	0.878	0.916	0.71	0.484	0.471
Compound_81	O/C=C/C(=C\CC(=O)O)/Cc1ccc(cc1)O	0.651	0.33	0.145	0.248	0.614	0.556	0.919	0.568	0.465	0.782	0.183
Compound_82	C=C/C(=C\C(C(=O)O)O)/Cc1ccc(cc1)O	0.677	0.327	0.131	0.353	0.386	0.301	0.73	0.926	0.202	0.615	0.242
Compound_83	Oc1ccc(cc1)C(=C)c1cc(O)c(c(c1)O)O	0.975	0.72	0.725	0.641	0.947	0.445	0.964	0.995	0.935	0.934	0.789
Compound_84	Oc1ccc(cc1)C(c1ccc(c(c1)O)O)(C)C	0.978	0.535	0.789	0.643	0.957	0.524	0.869	0.993	0.229	0.949	0.787