Index	SMILES	Probability	Label
Compound_1	FC(C(N(C)C)(F)F)F	0.25	0.0
Compound_2	FC([C@]1(F)C(F)(F)[C@@](C1(F)F)(F)C(F)(F)F)(F)F	0.92	1.0
Compound_3	FC(=C(C(F)(F)F)C(F)(F)F)C(C(F)(F)F)(F)F	0.63	1.0
Compound_4	FC(C(F)(F)F)(C(F)(F)F)OC(C(Br)(F)F)(F)F	0.98	1.0
Compound_5	FC(C(C(F)(F)F)(N1C(F)(F)C(F)(F)OC(C1(F)F)(F)F)F)(F)F	0.1	0.0
Compound_6	FC(C(C(C(COP1(=NP(=NP(=N1)(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(F)F)(F)F)(F)F)(F)F)(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.07	0.0
Compound_7	OC(=O)C(C(C(C(C(C(Cl)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.98	1.0
Compound_8	OCC(CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I	0.96	1.0
Compound_9	C=CC(=O)OCC(CC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)O	0.89	1.0
Compound_10	OC(CC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)COC(=O)C(=C)C	0.63	1.0
Compound_11	OC(CC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)COC(=O)C(=C)C	0.49	0.0
Compound_12	OCCCCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_13	FC(=O)C(C(F)(F)F)(OC(C(OC(C(F)(F)F)(C(=O)F)F)(F)F)(F)F)F	0.79	1.0
Compound_14	FC(=C(F)F)OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F	0.65	1.0
Compound_15	FC(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(C(Cl)(F)F)F	1.0	1.0
Compound_16	FC(C(C(C(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)F	1.0	1.0
Compound_17	OCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_18	FC(C(OCC(C(F)F)(F)F)(F)F)F	0.94	1.0
Compound_19	FC(C(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)F	0.94	1.0
Compound_20	FC(=O)C(C(F)(F)F)(OC(C(F)(F)F)(F)F)F	0.83	1.0
Compound_21	C=COC(=O)CC(C(C(F)(F)F)(F)F)(F)F	0.97	1.0
Compound_22	FC1(F)SC(S1)(F)F	0.97	1.0
Compound_23	OC(=O)C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F	0.97	1.0
Compound_24	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(S(=O)(=O)Nc1ccc(cc1)S(=O)(=O)[O-])F	0.95	1.0
Compound_25	FC(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)F	0.98	1.0
Compound_26	FC(C(C(C(F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(C(F)(F)F)F)F)(F)F	0.81	1.0
Compound_27	CC(C(C(F)F)(F)F)O	0.79	1.0
Compound_28	O=C(C(C(C(F)(F)F)(F)F)(F)F)CC(=O)C(C)(C)C	0.96	1.0
Compound_29	FC1=C(Cl)C(C(C1(F)F)(F)F)(F)F	0.79	1.0
Compound_30	FC(C(C(F)(F)F)(F)F)(CC1OC1)F	0.9	1.0
Compound_31	FC(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)(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	0.22	0.0
Compound_32	C=CC(=O)OCCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_33	C=CC(C(C(C(C(C(C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_34	FC1(F)CNCC1(F)F	0.18	0.0
Compound_35	ICCC(C(C(C(C(C(CCI)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_36	ICCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_37	BrCCC(C(Br)(F)F)(F)F	0.89	1.0
Compound_38	C=CC(C(Br)(F)F)(F)F	0.98	1.0
Compound_39	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(COP1(=NP(=NP(=N1)(OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.07	0.0
Compound_40	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(c1ccc(cc1)P(c1ccc(cc1)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)c1ccc(cc1)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.97	1.0
Compound_41	FC(C(C(S(=O)(=O)[O-])(F)F)(F)F)(C(F)(F)F)F	0.99	1.0
Compound_42	CC(c1ccc(cc1)[I+]c1ccc(cc1)C(C)(C)C)(C)C	0.99	1.0
Compound_43	FC(C(COCC1OC1)(F)F)F	0.85	1.0
Compound_44	FC(=C(F)F)OC(C(OC(=C(F)F)F)(F)F)(F)F	0.64	1.0
Compound_45	ICCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_46	FC(C(C(=O)N)(F)F)F	0.7	1.0
Compound_47	FC(=C(C(C(F)(F)F)(C(F)(F)F)F)F)C(F)(F)F	0.67	1.0
Compound_48	O=C(C(F)(F)F)CC(=O)C(C(F)(F)F)(F)F	0.92	1.0
Compound_49	OC(=O)C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.98	1.0
Compound_50	ICC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_51	FC(S(=O)(=O)F)C(F)(F)F	0.98	1.0
Compound_52	O=C(C(C(F)(F)F)(F)F)CC(=O)C(C)(C)C	0.84	1.0
Compound_53	FC(=C(C(C(F)(F)F)(C(F)(F)F)F)F)F	0.9	1.0
Compound_54	C=CC(=O)OC(C(F)(F)F)C(F)(F)F	0.99	1.0
Compound_55	OCC(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	0.97	1.0
Compound_56	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(c1nc(nc(n1)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.56	1.0
Compound_57	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCc1ccc(cc1)P(c1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)c1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.97	1.0
Compound_58	FC(C(C(F)(F)F)(F)F)F	0.13	0.0
Compound_59	O=C(C(=C)C)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_60	O=C(OC(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(=C)C(=O)O	0.83	1.0
Compound_61	C=Cc1ccc(cc1)COC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.96	1.0
Compound_62	O=C(n1nc(cc1C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)c1ccccc1	0.31	0.0
Compound_63	CCCCCCC(C(Br)(F)F)(F)F	0.99	1.0
Compound_64	CC(=O)n1nc(cc1C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.26	0.0
Compound_65	OCC(C(C(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(F)F)(C(F)(F)F)F)(F)F	0.92	1.0
Compound_66	OC(=O)CCC(C(Br)(F)F)(F)F	0.92	1.0
Compound_67	OC(=O)C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_68	O=C([C@@H]1CC[C@](C1(C)C)(C)C(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.68	1.0
Compound_69	OC(=O)C(C(C(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(F)F)(C(F)(F)F)F)(F)F	0.94	1.0
Compound_70	O=C(C=CC(=O)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.95	1.0
Compound_71	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1ccc(cc1NC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)Cl	0.56	1.0
Compound_72	FC(C(C(C(C(C(C(F)(F)F)(I)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_73	OCC(C(F)(F)F)(C(C(C(F)(F)F)(C(F)(F)F)F)F)F	0.92	1.0
Compound_74	FC(C(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)(F)F)(OC(C(F)(F)F)(C(F)(F)F)F)F	0.99	1.0
Compound_75	ICC(C(C(OC(C(F)(F)F)F)(F)F)(F)F)C(F)(F)F	0.97	1.0
Compound_76	OP(=O)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	0.95	1.0
Compound_77	CC(CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I	1.0	1.0
Compound_78	OCC(COCC(C(F)F)(F)F)O	0.67	1.0
Compound_79	C=CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.96	1.0
Compound_80	ClS(=O)(=O)c1ccc(cc1)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_81	OCCCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_82	CC[N+](C(OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C)(CC)CC	0.8	1.0
Compound_83	Fc1c(F)c(OC(C(OC(C(F)(F)F)(C(=O)F)F)(F)F)(C(F)(F)F)F)c(c(c1F)F)F	0.95	1.0
Compound_84	O=C(C(=C)C)OCC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.97	1.0
Compound_85	O=C=Nc1ccc2c(c1)C(F)(F)OC(O2)(F)F	0.09	0.0
Compound_86	O=CC(C(C(C(F)F)(F)F)(F)F)(F)F	0.8	1.0
Compound_87	OCC(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	0.93	1.0
Compound_88	FC1(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)C(C(C1(F)F)(F)F)(F)F	0.71	1.0
Compound_89	N#CSCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.88	1.0
Compound_90	FC(C(F)(F)F)OC(C(C(F)(F)F)(OC(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)(F)F)F)(F)F	0.79	1.0
Compound_91	OCCN(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)CCO	0.59	1.0
Compound_92	OCCNCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.39	0.0
Compound_93	FC(=O)C(C(F)(F)F)(OC(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)(F)F)F	0.89	1.0
Compound_94	O=C(C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)OOC(=O)C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.55	1.0
Compound_95	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(c1ccc(cc1)P(c1ccc(cc1)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)c1ccc(cc1)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	0.97	1.0
Compound_96	O=C(C(=C)C)SCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.77	1.0
Compound_97	FC(C1(C(F)(F)F)C(F)(F)C(C1(F)F)(F)F)(F)F	0.93	1.0
Compound_98	OCC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.66	1.0
Compound_99	FC(C(C(C(Cl)(Cl)Cl)(F)F)(F)F)(F)F	0.75	1.0
Compound_100	OC(=O)C(C(C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.98	1.0
Compound_101	FC(=O)C(C(F)(F)F)(OC(F)(F)F)F	0.81	1.0
Compound_102	FC(=C(OC(C(S(=O)(=O)F)(F)F)(F)F)F)F	0.94	1.0
Compound_103	FC(C(C(C(C(C(COC(=O)c1ccccc1S(=O)(=O)[O-])(F)F)(F)F)(F)F)(F)F)(F)F)F	0.92	1.0
Compound_104	C=COCC(C(F)F)(F)F	0.95	1.0
Compound_105	FC(C(C(S(=O)(=O)Cl)(F)F)(F)F)(C(F)(F)F)F	0.97	1.0
Compound_106	C=CC(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_107	FC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)F	0.83	1.0
Compound_108	CCN(CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-]	0.12	0.0
Compound_109	FC(C(=C(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(F)F)C(F)(F)F)(F)F	0.53	1.0
Compound_110	FC(=C(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F)C(F)(F)F	0.62	1.0
Compound_111	FC(C(C(C(C(F)(F)F)(F)F)(F)F)C(F)(F)F)(F)F	0.12	0.0
Compound_112	CCOC(=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	0.98	1.0
Compound_113	CCCCCCCCn1cc[n+](c1)C	0.3	0.0
Compound_114	FC(C1(F)C(F)(F)C(F)(F)C2(C(C1(F)F)(F)C(F)(F)C(C(C2(F)F)(F)F)(F)F)F)(F)F	0.73	1.0
Compound_115	FC(C1(F)C(F)(C(F)(F)F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F	0.85	1.0
Compound_116	FC(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F)F	0.88	1.0
Compound_117	NCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.7	1.0
Compound_118	FC(C(C(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.59	1.0
Compound_119	FC(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.22	0.0
Compound_120	FC(C(C(C(C(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	0.22	0.0
Compound_121	FC(C(C(C(C(C(C(C(I)(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	0.98	1.0
Compound_122	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.22	0.0
Compound_123	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.22	0.0
Compound_124	CC(=C)C(=O)SCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.77	1.0
Compound_125	O=C(C(=C)C)SCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	0.77	1.0
Compound_126	OC(=O)C(C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_127	C=CC(=O)OCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_128	FC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.96	1.0
Compound_129	FC1C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.9	1.0
Compound_130	C=CC(=O)OCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_131	CCN(C(C(C(F)(F)F)F)(F)F)CC	0.16	0.0
Compound_132	FC(C(C(C(C(C(COP(=O)(O)O)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.83	1.0
Compound_133	CCOC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_134	C[n+]1ccn(c1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.02	0.0
Compound_135	CCCC[n+]1ccn(c1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.03	0.0
Compound_136	Fc1c(F)c(F)c(c2c1c(F)c(c(c2F)F)F)F	0.97	1.0
Compound_137	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CNCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.76	1.0
Compound_138	CCCCNS(=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	0.4	0.0
Compound_139	FC(C(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)Cc1ccc(cc1)P(c1ccc(cc1)CC(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)C(F)(F)F)c1ccccc1)(F)F	0.97	1.0
Compound_140	O=C(C(C(C(F)(F)F)(F)F)(F)F)n1cncc1	0.13	0.0
Compound_141	OC(=O)C(OC(C(OC(C(OC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.9	1.0
Compound_142	OCC(OC(C(OC(C(OC(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.69	1.0
Compound_143	FC(C(F)(F)F)OC(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)(F)F	0.83	1.0
Compound_144	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_145	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(C(F)(F)F)F)(F)F)(F)F	0.74	1.0
Compound_146	FC(C(C(C1(F)OC(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_147	FC(C(C(Br)(F)F)(F)F)(C(Br)(F)F)F	0.99	1.0
Compound_148	FC(C(C(C(C(Br)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.99	1.0
Compound_149	ClC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.58	1.0
Compound_150	FC(C(C(C(I)(F)F)(F)F)(F)F)(C(C(C(C(I)(F)F)(F)F)(F)F)(F)F)F	0.99	1.0
Compound_151	ClC(=O)C(C(C(C(C(=O)Cl)(F)F)(F)F)(F)F)(F)F	0.84	1.0
Compound_152	FC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)F	0.81	1.0
Compound_153	FC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)Cl)(F)F	0.89	1.0
Compound_154	ClC1=C(Cl)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.6	1.0
Compound_155	COC1=C(Cl)C(C(C1(F)F)(F)F)(F)F	0.5	0.0
Compound_156	C=CC(C(I)(F)F)(F)F	0.99	1.0
Compound_157	SCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_158	SCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_159	SCCC(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	0.97	1.0
Compound_160	[O-]C(=O)C[N+](CCCNS(=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)(C)C	0.23	0.0
Compound_161	[O-]C(=O)C[N+](CCCNS(=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)(C)C	0.23	0.0
Compound_162	O=C(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)OCC(F)(F)F	0.96	1.0
Compound_163	CCC(C(=O)Nc1ccc(c(c1)O)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)Oc1ccc(cc1C(CC)(C)C)C(CC)(C)C	0.45	0.0
Compound_164	FC(=C(OC(OC(C(F)(F)F)(F)F)(F)F)F)F	0.84	1.0
Compound_165	FC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(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)(F)F)F)(F)F)F	0.89	1.0
Compound_166	FC(C(C(C(F)(F)F)(F)F)(F)F)(CCON(=O)=O)F	0.95	1.0
Compound_167	NC(=O)C(C(C(C(C(C(C(=O)N)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.38	0.0
Compound_168	N#CC(=NOC(=O)OC(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)(C)C)c1ccccc1	0.49	0.0
Compound_169	C=CC(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	0.99	1.0
Compound_170	FC(=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	0.89	1.0
Compound_171	FC(C(I)(F)F)(I)F	0.99	1.0
Compound_172	ICC(C(F)(F)F)(F)F	0.96	1.0
Compound_173	NC(=O)C(C(F)(F)F)(F)F	0.52	1.0
Compound_174	FC(C(F)(F)F)(C(F)(F)F)C(F)(F)F	0.8	1.0
Compound_175	FC(C(C(F)(F)F)(C(F)(F)F)F)(C(F)(F)F)C(F)(F)F	0.8	1.0
Compound_176	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(C(C(F)(F)F)(F)F)F)(F)F)(F)F	0.82	1.0
Compound_177	FC1(C(F)(F)F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.81	1.0
Compound_178	CC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.94	1.0
Compound_179	FC(C(C(Cl)(F)F)(F)F)(C(Cl)(F)F)F	0.79	1.0
Compound_180	NCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.67	1.0
Compound_181	OCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_182	NCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.67	1.0
Compound_183	FC(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.73	1.0
Compound_184	FC(C(C(C(C(C(F)(F)F)(I)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_185	NCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.73	1.0
Compound_186	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(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	0.22	0.0
Compound_187	FC(=C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F	0.87	1.0
Compound_188	NC(=O)C(C(C(C(C(=O)N)(F)F)(F)F)(F)F)(F)F	0.37	0.0
Compound_189	FC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.9	1.0
Compound_190	OCC(C(C(C(CO)(F)F)(F)F)(F)F)(F)F	0.9	1.0
Compound_191	FC1=C(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.58	1.0
Compound_192	FC(C(C(C(C(=O)N)(F)F)(F)F)(F)F)F	0.68	1.0
Compound_193	FC(C(C(C(COC(=O)C(=C)C)(F)F)(F)F)(F)F)F	0.99	1.0
Compound_194	OCc1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.88	1.0
Compound_195	OCc1ccc(cc1)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	0.92	1.0
Compound_196	FC(C(C(F)(F)F)(F)F)(CNCC(C(C(F)(F)F)(F)F)(F)F)F	0.71	1.0
Compound_197	COC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.93	1.0
Compound_198	CCOC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.98	1.0
Compound_199	C=COC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.97	1.0
Compound_200	C=CC(=O)OCC(C(F)(F)F)(F)F	0.99	1.0
Compound_201	FC(=C(C(C(F)(F)F)(F)F)F)F	0.87	1.0
Compound_202	FC(C(F)(F)F)(N(C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)F	0.17	0.0
Compound_203	FC(=C(C(F)(F)F)F)C(F)(F)F	0.9	1.0
Compound_204	FC(C(COC(=O)C(=C)C)(F)F)C(F)(F)F	0.99	1.0
Compound_205	O=C(C(C(C(F)(F)F)(F)F)(F)F)C=C(C(C)(C)C)[O-]	0.26	0.0
Compound_206	OP(=O)(OCCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O	0.98	1.0
Compound_207	CC(C(C(F)(F)F)(F)F)O	0.61	1.0
Compound_208	CC(=O)C(C(F)(F)F)(F)F	0.88	1.0
Compound_209	FC(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(F)F	0.8	1.0
Compound_210	FC(C(C(C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.85	1.0
Compound_211	FC(C1(F)C(F)(F)C(F)(C(F)(F)F)C(C(C1(F)F)(F)C(F)(F)F)(F)F)(F)F	0.77	1.0
Compound_212	FC(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)C(F)(F)F)(F)F	0.8	1.0
Compound_213	FC(C(F)(F)F)OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(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)(F)F)F)(F)F)F)(F)F	0.78	1.0
Compound_214	ICC(C(C(F)(F)F)(F)F)(F)F	0.96	1.0
Compound_215	NCC(C(C(F)(F)F)(F)F)(F)F	0.67	1.0
Compound_216	N#CC(C(C(F)(F)F)(F)F)(F)F	0.72	1.0
Compound_217	O=CC(C(C(F)(F)F)(F)F)(F)F	0.86	1.0
Compound_218	CC(C(C(C(F)(F)F)(F)F)(F)F)O	0.61	1.0
Compound_219	ClC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.65	1.0
Compound_220	NC(=N)C(C(C(F)(F)F)(F)F)(F)F	0.05	0.0
Compound_221	ClC(C(C(F)(F)F)(Cl)Cl)(C(F)(F)F)Cl	0.76	1.0
Compound_222	FC(C(C(C(Br)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_223	FC(C(C(C(F)(F)F)(F)F)(I)F)(F)F	0.98	1.0
Compound_224	FC(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)(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	0.22	0.0
Compound_225	FC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F	0.22	0.0
Compound_226	FC(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	0.67	1.0
Compound_227	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.22	0.0
Compound_228	FC(=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	0.89	1.0
Compound_229	COC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_230	O=C1OC(=O)C(C(C1(F)F)(F)F)(F)F	0.83	1.0
Compound_231	OC(=O)C(C(C(C(=O)O)(F)F)(F)F)(F)F	0.87	1.0
Compound_232	FC1(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.87	1.0
Compound_233	C=CC(=O)OCC(C(C(C(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_234	FC(=C(C(C(C(F)(F)F)(F)F)(F)F)F)F	0.87	1.0
Compound_235	OCC(C(C(CO)(F)F)(F)F)(F)F	0.85	1.0
Compound_236	FC(C(C(C(F)F)(F)F)(F)F)F	0.73	1.0
Compound_237	OC(=O)C(C(C(=O)O)(F)F)(F)F	0.85	1.0
Compound_238	OCC1CC(C1(F)F)(F)F	0.61	1.0
Compound_239	COC(=O)C(C(F)(F)F)(F)F	0.94	1.0
Compound_240	C=C(C(F)(F)F)C(F)(F)F	0.95	1.0
Compound_241	FC(CCCCC(COP1(=NP(=NP(=N1)(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.09	0.0
Compound_242	CCC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_243	FC(=C(C(=C(F)F)C(F)(F)F)F)F	0.91	1.0
Compound_244	CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_245	CC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I	1.0	1.0
Compound_246	FC(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)(CC1CO1)F	0.84	1.0
Compound_247	OCC[N+](CCC(=O)O)(CCO)CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.02	0.0
Compound_248	COC(=O)C(C(F)(F)F)(OC(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)(F)F)F	0.88	1.0
Compound_249	FC(C(F)(F)F)(Cl)F	0.79	1.0
Compound_250	FC(C(C(C(F)(F)F)(F)F)(F)F)(S(=O)(=O)NS(=O)(=O)C(F)(F)F)F	0.93	1.0
Compound_251	FC(C(C(OC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.83	1.0
Compound_252	FC(C(OC1(F)C(F)(F)C(F)(OC(C(C(F)(F)F)(F)F)(F)F)C(C(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.92	1.0
Compound_253	C=CC(=O)OCC1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.99	1.0
Compound_254	FC(C(OCC(F)(F)F)(F)F)F	0.91	1.0
Compound_255	ICCC(C(F)(F)F)(F)F	0.96	1.0
Compound_256	FC(=O)C(C(F)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F	0.88	1.0
Compound_257	[O-]C(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(S(=O)(=O)N)(F)F)(F)F)F)(F)F)F	0.59	1.0
Compound_258	FCC(C(C(C(C(C(C(C(C(C(OC(=O)C(=C)C)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_259	OCCN(CCO)CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.06	0.0
Compound_260	CCOC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_261	[O-]S(=O)(=O)c1ccccc1OC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_262	NCC(C(F)(F)F)(F)F	0.67	1.0
Compound_263	OCC(C(F)(F)F)(F)F	0.91	1.0
Compound_264	OC(C(C(F)(F)F)(F)F)O	0.61	1.0
Compound_265	FC(C(Br)(F)F)(C(F)(F)F)F	0.99	1.0
Compound_266	O=N(=O)c1ccc2c(c1)[nH]c(n2)C(C(F)(F)F)(F)F	0.91	1.0
Compound_267	FC(C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(C(F)(F)F)F)(F)F	0.77	1.0
Compound_268	NCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.69	1.0
Compound_269	NC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.56	1.0
Compound_270	FC(C(C(C(C(C(C(C(Br)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_271	OCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_272	FC(C(C(C(C(S(=O)(=O)Cl)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F	0.97	1.0
Compound_273	FC(C(C(C(C(C(COS(=O)(=O)c1ccc(cc1)C)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.97	1.0
Compound_274	COC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_275	CCOC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_276	C=COC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_277	CCOC(=O)C(C(C(C(=O)OCC)(F)F)(F)F)(F)F	0.82	1.0
Compound_278	C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F	0.99	1.0
Compound_279	FC(=O)C(C(OC(F)(F)F)(F)F)(F)F	0.81	1.0
Compound_280	COC(C(F)F)(F)F	0.67	1.0
Compound_281	CCOC(=O)C(C(F)(F)F)(F)F	0.98	1.0
Compound_282	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCSSCCC(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	0.77	1.0
Compound_283	FC(C(C(F)(F)F)F)F	0.27	0.0
Compound_284	FC(C(COC(=O)C(=C)C)(F)F)F	0.99	1.0
Compound_285	O=C(C(=C)C)OCC(C(F)(F)F)(F)F	0.99	1.0
Compound_286	O=C(N=NC(=O)OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.19	0.0
Compound_287	FC(C(S(=O)(=O)O)(F)F)F	0.97	1.0
Compound_288	Fc1ccc2c(c1)[nH]cc2CCNCc1cccc(c1)OCC(C(F)F)(F)F	0.03	0.0
Compound_289	O=C(C(=C)C)OCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_290	CC(=C)C(=O)OCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_291	O=C(C(=C)C)OCC(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	0.99	1.0
Compound_292	C=CC(=O)OC(C(C(C(C(C(C(C(C(C(CF)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	1.0	1.0
Compound_293	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(C(C(F)(F)F)(C(F)(F)F)F)F)(F)F)(F)F	0.82	1.0
Compound_294	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)(F)F)(F)F	0.74	1.0
Compound_295	C=CC(=O)OCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_296	O=C(C(=C)C)OCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_297	NNC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(=O)NN)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.58	1.0
Compound_298	OCCCCCCCCCSCCCC(C(F)(F)F)(F)F	0.9	1.0
Compound_299	BrC(=C)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_300	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C=CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.59	1.0
Compound_301	FC1(F)C(F)(F)C(F)(F)C(C2(C1(F)C(F)(F)C(C(C2(F)C(F)(F)F)(F)F)(F)F)F)(F)F	0.72	1.0
Compound_302	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)NCCC[N+](CCC(=O)O)(C)C	0.04	0.0
Compound_303	[O-]C(=O)CN(C(=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	0.39	0.0
Compound_304	OCCN(S(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C	0.58	1.0
Compound_305	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCP(=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)O)F	0.96	1.0
Compound_306	ClC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.73	1.0
Compound_307	ClC(=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	0.94	1.0
Compound_308	OCCOCCN(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)CCC	0.44	0.0
Compound_309	O=C(Nc1ccc(c(c1)NC(=O)N1CC1C)C)OC(CSCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CSCCC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.01	0.0
Compound_310	OC(=O)C(C(C(C(C(C(C(C(Cl)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.98	1.0
Compound_311	OC(=O)C(C(C(C(C(C(C(C(C(C(Cl)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F	0.98	1.0
Compound_312	O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)NCCC[N+](C)(C)C	0.07	0.0
Compound_313	OC(CC(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)COP(=O)(O)O	0.83	1.0
Compound_314	FC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(CC1OC1)F	0.77	1.0
Compound_315	C=CC(=O)OCC(C(C(F)(F)F)F)(F)F	0.99	1.0
Compound_316	CC(c1c(F)c(F)c(c(c1F)F)C(C)(C)C)(C)C	0.93	1.0
Compound_317	FC(C(C(C(OC(C(C(F)(F)F)(F)F)(F)F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F	0.82	1.0
Compound_318	O=c1oc(=O)n(c2c1cccc2)CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.04	0.0
Compound_319	FC(C(F)(F)F)OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(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)(F)F)F)(F)F)F)(F)F)F)(F)F	0.78	1.0
Compound_320	O=C(ON1C(=O)CCC1=O)OCc1ccc(cc1)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.5	0.0
Compound_321	O=C(ON1C(=O)CCC1=O)OCc1ccc(cc1)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	0.5	0.0
Compound_322	OC(=O)C(OC(C(OC(C(OC(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.68	1.0
Compound_323	OC(=O)C(OC(C(OC(C(=O)O)(F)F)(F)F)(F)F)(F)F	0.68	1.0
Compound_324	FC(C(N1C(F)(F)C(F)(F)OC(C1(F)F)(F)F)(F)F)(F)F	0.11	0.0
Compound_325	C#CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_326	FC(C(C(C(C(F)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F	0.82	1.0
Compound_327	FC(C(C(C(C(C(C(C(C(Br)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_328	C=CC(=O)OCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_329	FC(=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F	0.88	1.0
Compound_330	FC1=C(F)C(C(C1(F)F)(F)F)(F)F	0.61	1.0
Compound_331	O=C(C(C(C(F)(F)F)(F)F)(F)F)CC(=O)c1cccs1	0.87	1.0
Compound_332	O=C(C(C(C(F)(F)F)(F)F)(F)F)NCc1ccccc1	0.39	0.0
Compound_333	OC(=O)C(C(F)(F)F)C(F)(F)F	0.98	1.0
Compound_334	FC(C(F)(F)F)(COS(=O)(=O)c1ccc(cc1)C)F	0.97	1.0
Compound_335	FC(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)(c1nc(nc(n1)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)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	0.56	1.0
Compound_336	C=CC(=O)OCCC(C(C(C(C(C(C(C(C(F)(F)C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_337	C[N+](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)(C)C	0.35	0.0
Compound_338	FC(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)C(=O)O	0.93	1.0
Compound_339	FC(C(COP1(=NP(=NP(=N1)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)(F)F)F	0.07	0.0
Compound_340	O=C(C(=C)C)OCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_341	C=CCOC(C(C(F)(F)F)F)(F)F	0.97	1.0
Compound_342	FC(C(C(C(F)(F)F)(F)F)(C(F)(F)F)F)(F)F	0.74	1.0
Compound_343	FC(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)S(=O)(=O)NCCC[N+](C)(C)C	0.04	0.0
Compound_344	O=C(c1ccc(cc1)OC(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)NCCC[N+](C)(C)C	0.01	0.0
Compound_345	FC(=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)S(=O)(=O)Cl	0.91	1.0
Compound_346	FC(=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)S(=O)(=O)[O-]	0.86	1.0
Compound_347	FC(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)S(=O)(=O)Cl	0.91	1.0
Compound_348	[O-]S(=O)(=O)c1ccc(cc1)OC(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	0.94	1.0
Compound_349	O=C(CC(S(=O)(=O)[O-])C(=O)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.71	1.0
Compound_350	FC(C(OC(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.61	1.0
Compound_351	C=CC(=O)OCCNS(=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	0.47	0.0
Compound_352	NCc1ccc(cc1)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	0.54	1.0
Compound_353	FC(=C(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F)F	0.41	0.0
Compound_354	O=C(C(C(F)(F)F)(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F)C(C(F)(F)F)(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F	0.57	1.0
Compound_355	FC(C(C(C(F)(F)F)(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F)(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F)(F)F	0.59	1.0
Compound_356	FC(C(C(C(C(C(COCC(OS(=O)(=O)[O-])COCC(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	0.88	1.0
Compound_357	CC(=C)C(=O)OCCC(C(C(C(C(F)(F)C)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_358	N#CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_359	FC(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)F	0.76	1.0
Compound_360	FC(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)(P(=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)O)F	0.94	1.0
Compound_361	OC(CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)COP(=O)(OCC(CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)O	0.58	1.0
Compound_362	O=C(CC(S(=O)(=O)[O-])C(=O)OCC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.72	1.0
Compound_363	FC(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)Oc1ccc(cc1)CP(=O)(O)O	0.52	1.0
Compound_364	COC(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F	0.57	1.0
Compound_365	ClC(=O)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_366	ClC(=O)CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.95	1.0
Compound_367	ClCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_368	FC(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)(OC(C(OC(F)(F)F)(F)F)(F)F)F	0.79	1.0
Compound_369	FC(C(C(C1(F)C(F)(F)OC(C1(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F	0.91	1.0
Compound_370	N#CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.94	1.0
Compound_371	FC(C(C(C(Cl)(F)F)(F)F)(F)F)(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)F	0.74	1.0
Compound_372	FC(S(=O)(=O)Cl)(C(F)(F)F)F	0.97	1.0
Compound_373	FC(=C(C(C(C(C(C(C(C(C(Oc1ccc(cc1)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)F	0.93	1.0
Compound_374	FC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCc1ccc(cc1)C(c1ccccc1)(c1ccccc1)O)F	0.82	1.0
Compound_375	O=C(C(=C)C)OCCC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F	0.98	1.0
Compound_376	FC(=O)C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F	0.88	1.0
Compound_377	FC(C(I)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F	0.99	1.0
Compound_378	FC(C(Cl)(F)F)(C(F)(F)F)Cl	0.79	1.0
Compound_379	FC(C(Cl)(F)F)(C(Cl)(F)F)F	0.79	1.0
Compound_380	NC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.49	0.0
Compound_381	CCOC(=O)CC(=O)C(C(F)(F)F)(F)F	0.95	1.0
Compound_382	FC(C(C(C(C(F)(F)F)(C(F)(F)F)Cl)(F)F)(F)F)(F)F	0.8	1.0
Compound_383	FC(C(C(OC(F)(F)F)(F)F)(F)F)F	0.52	1.0
Compound_384	FC(C(F)(F)F)(C(F)(F)F)I	0.99	1.0
Compound_385	CC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.93	1.0
Compound_386	OC(=O)C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_387	C=CC(C(C(C(C=C)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_388	ClC(=O)C(C(C(C(=O)Cl)(F)F)(F)F)(F)F	0.84	1.0
Compound_389	C=CC(=O)OCC(C(C(COC(=O)C=C)(F)F)(F)F)(F)F	0.98	1.0
Compound_390	OCCCC(C(C(F)(F)F)(F)F)(F)F	0.94	1.0
Compound_391	ICC(C(F)F)(F)F	0.97	1.0
Compound_392	FC(C(F)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F	0.98	1.0
Compound_393	COC(=O)C(C(F)(F)F)(C(F)(F)F)F	0.92	1.0
Compound_394	FC(C(C(C(C(F)(F)F)(I)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_395	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)CCOC(=O)Nc1ccc(c(c1)NC(=O)OC(COC(=O)C(=C)C)C)C	0.32	0.0
Compound_396	CCN(S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)Nc1ccc(c(c1)NC(=O)OC(COC(=O)C(=C)C)C)C	0.32	0.0
Compound_397	CCN(S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)Nc1ccc(c(c1)NC(=O)OC(COC(=O)C(=C)C)C)C	0.32	0.0
Compound_398	CCN(S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)Nc1ccc(c(c1)NC(=O)OC(COC(=O)C(=C)C)C)C	0.32	0.0
Compound_399	CCN(S(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CCOC(=O)Nc1ccc(c(c1)NC(=O)OC(COC(=O)C(=C)C)C)C	0.32	0.0
Compound_400	O=C(C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F	0.87	1.0
Compound_401	FC(=C(F)F)C(=C(F)F)F	0.87	1.0
Compound_402	OC(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F	0.86	1.0
Compound_403	FC(=CC(F)(F)F)F	0.9	1.0
Compound_404	FC(=C(F)F)OC(C(C(F)(F)F)(OC(C(C(=O)O)(F)F)(F)F)F)(F)F	0.73	1.0
Compound_405	FC1=C(F)C(C1(F)F)(F)F	0.77	1.0
Compound_406	FC1(F)C(F)(F)OS1(=O)=O	0.93	1.0
Compound_407	N#CC(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F	0.81	1.0
Compound_408	O=C1OC(=O)C(C1(F)F)(F)F	0.88	1.0
Compound_409	FC(=C(OC(OC(F)(F)F)(F)F)F)F	0.88	1.0
Compound_410	O=C(C(C(F)(F)F)(F)F)n1cncc1	0.15	0.0
Compound_411	FC(C(I)(F)F)(C(F)(F)F)F	0.98	1.0
Compound_412	O=C(Nc1ccc(c(c1)NC(=O)N1CC1C)C)OC(CSCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CSCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.01	0.0
Compound_413	O=C(Nc1ccc(c(c1)NC(=O)N1CC1C)C)OC(CSCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)CSCCC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F	0.01	0.0
Compound_414	FC(=C(C(C(F)(F)F)(F)F)F)C(F)(F)F	0.77	1.0
Compound_415	O=C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)C(F)(F)F	0.82	1.0
Compound_416	O=C1OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F	0.54	1.0
Compound_417	C=CCOC(C(S(=O)(=O)F)(F)F)(F)F	0.94	1.0
Compound_418	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)F)(F)F)(F)F)F	0.98	1.0
Compound_419	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	0.89	1.0
Compound_420	C=CC(=O)OCC(C(F)F)(F)F	0.99	1.0
Compound_421	CN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)C(C(C(F)(F)F)(F)F)(F)F	0.52	1.0
Compound_422	FC(C(F)(F)F)(C(F)(F)F)CC1OC1	0.73	1.0
Compound_423	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)CCCS(=O)(=O)[O-]	0.66	1.0
Compound_424	FC(C(I)(F)F)(C(F)(F)F)F	0.98	1.0
Compound_425	CC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.99	1.0
Compound_426	OC(=O)C(C(C(C(C(C(C(C(Cl)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F)(F)F)(Cl)F	0.98	1.0
Compound_427	OCC(C(C(C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.94	1.0
Compound_428	FC(=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)F	0.87	1.0
Compound_429	OCCC(C(C(F)(F)F)(F)F)(F)F	0.97	1.0
Compound_430	FC(C(C(=O)O)(F)F)F	0.97	1.0
Compound_431	OCC(C(F)F)(F)F	0.88	1.0
Compound_432	FC(C(C(F)(F)F)(F)F)([I+]c1ccccc1)F	0.98	1.0
Compound_433	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)([I+]c1ccccc1)F	0.98	1.0
Compound_434	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C([I+]c1ccccc1)(F)F)F	0.98	1.0
Compound_435	OCC(C(F)(F)F)(OC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.95	1.0
Compound_436	FC(COS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_437	OC(=O)C(C(C(OC(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F	0.95	1.0
Compound_438	FC(C(C(C1(F)C(F)(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.58	1.0
Compound_439	OC(=O)C(OC(C(OC(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.9	1.0
Compound_440	OP(=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)O	0.95	1.0
Compound_441	CN(CCCS(=O)(=O)[O-])CCCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.13	0.0
Compound_442	OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_443	FC(=O)C(C(Cl)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F	0.9	1.0
Compound_444	O=C(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F	0.83	1.0
Compound_445	O=C(C(C(C(F)(F)F)(F)F)(F)F)C(C(F)(F)F)(C(F)(F)F)F	0.81	1.0
Compound_446	O=C(NCCSS(=O)(=O)[O-])OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.43	0.0
Compound_447	FC(C(F)(F)F)(C(F)(F)F)[I+]c1ccccc1	0.98	1.0
Compound_448	OCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.95	1.0
Compound_449	C=CCC(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)C(=O)OC	0.91	1.0
Compound_450	FC(C(F)(F)F)(OC1(F)OC(F)(C(F)(F)F)C(OC1(F)C(F)(F)F)(F)F)F	0.48	0.0
Compound_451	C=CCC(=C(C(C(F)(F)F)(F)F)F)C(F)(F)F	0.85	1.0
Compound_452	C=CC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_453	FC1(F)C(F)(F)S(=O)(=O)NS(=O)(=O)C1(F)F	0.85	1.0
Compound_454	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)F)(F)F	0.83	1.0
Compound_455	FC(C(C1(F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F)(C(F)(F)F)C(F)(F)F)(F)F	0.77	1.0
Compound_456	O=C1C=CC(=O)N1CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.17	0.0
Compound_457	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCCN1C(=O)C=CC1=O)F	0.17	0.0
Compound_458	O=C(ON1C(=O)CCC1=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	0.39	0.0
Compound_459	ICC(=O)NCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.82	1.0
Compound_460	ICC(=O)NCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.82	1.0
Compound_461	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(CCCN=N#N)F	0.72	1.0
Compound_462	N#N=NCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.72	1.0
Compound_463	FC(=C(C(C(C(F)(F)F)(F)F)(Oc1ccc(cc1)S(=O)(=O)[O-])F)C(F)(F)F)C(C(F)(F)F)(C(F)(F)F)F	0.89	1.0
Compound_464	FC(C(=C(C(C(F)(F)F)(F)F)Oc1ccc(cc1)S(=O)(=O)[O-])C(F)(F)F)(F)F	0.87	1.0
Compound_465	FC(C(OCC1OC1)(F)F)F	0.65	1.0
Compound_466	CCOCCOC(C(F)F)(F)F	0.98	1.0
Compound_467	CN(CCCS(=O)(=O)[O-])CCCNS(=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	0.13	0.0
Compound_468	CCCN(S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CC(=O)[O-]	0.19	0.0
Compound_469	FC(C(F)(F)F)C(C(C(F)(F)F)(C(F)(F)F)F)F	0.8	1.0
Compound_470	FC(C(C(C(C(F)(F)F)(C(F)(F)F)F)(Cl)F)(Cl)F)(F)F	0.79	1.0
Compound_471	FC(C(F)(F)F)(C(F)(F)F)OC(C(Cl)(F)F)(Cl)F	0.76	1.0
Compound_472	FC(=C(OC(C(Br)(F)F)(F)F)F)F	0.92	1.0
Compound_473	FC(C(F)(F)F)(c1nc(nc(n1)C(C(F)(F)F)(F)F)C(C(F)(F)F)(F)F)F	0.6	1.0
Compound_474	NCCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.13	0.0
Compound_475	O=C(C=CC(=O)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	0.92	1.0
Compound_476	OC(=O)C(C(C(OC(F)(F)F)(F)F)(F)F)(F)F	0.96	1.0
Compound_477	OC(=O)C(C(C(OC(C(Cl)(F)F)(Cl)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_478	FC(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)F)(F)F	0.74	1.0
Compound_479	COc1ccc(cc1)C(c1ccc(cc1)OC)(c1ccc(cc1)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)Cl	0.95	1.0
Compound_480	COc1ccc(cc1)C(c1ccccc1)(c1ccc(cc1)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)Cl	0.96	1.0
Compound_481	OC(=O)C(C(C(C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.98	1.0
Compound_482	OC(=O)C(C(C(C(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_483	FC(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(C(F)(F)F)C(F)(F)F)(F)F)(F)F)(F)F	0.75	1.0
Compound_484	OC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)COC(=O)C(=C)C	0.6	1.0
Compound_485	FC(OC(C(C(Br)(F)F)(Br)F)(F)F)(F)F	0.98	1.0
Compound_486	OC(CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)COC(=O)C(=C)C	0.63	1.0
Compound_487	O=C(C(=C)C)OC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F	0.92	1.0
Compound_488	OCc1ccc(cc1)OCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.85	1.0
Compound_489	OCc1ccc(cc1)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.88	1.0
Compound_490	ClC(=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	0.99	1.0
Compound_491	ICCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	1.0	1.0
Compound_492	ClSC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.97	1.0
Compound_493	OCC(C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.94	1.0
Compound_494	FC(C(C(F)(F)F)(F)F)(c1nc(nc(n1)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F)F	0.53	1.0
Compound_495	Clc1nc(OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)nc(n1)OCCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.3	0.0
Compound_496	FC(C(C(Br)(F)F)(F)F)(C(C(C(Br)(F)F)(F)F)(F)F)F	0.99	1.0
Compound_497	OC(CC(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[N+](C)(C)C	0.1	0.0
Compound_498	O=C(N1C(=O)CCC1=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.2	0.0
Compound_499	ClC(=O)OCC1c2cc(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)ccc2c2c1cc(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)cc2	0.76	1.0
Compound_500	FC(C(C(S(=O)(=O)O)(F)F)(C(F)(F)F)F)(F)F	0.95	1.0
Compound_501	OCCN(S(=O)(=O)C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)C	0.4	0.0
Compound_502	OCCN(S(=O)(=O)C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)CCO	0.45	0.0
Compound_503	CC(OC(COCC(CC(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)O)C)COCC(CC(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)O	0.47	0.0
Compound_504	CC(OC(COCC(CC(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)C)COCC(CC(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	0.47	0.0
Compound_505	CC(OC(COCC(CC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(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)O)C)COCC(CC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(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)O	0.56	1.0
Compound_506	COCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(CC(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	0.8	1.0
Compound_507	CC[NH+](CCC(=O)[O-])CCCNCC(CC(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)O	0.01	0.0
Compound_508	OC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CNCCC[N+](CCC(=O)[O-])(C)C	0.02	0.0
Compound_509	OCC[N+](CC(CC(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)O)(CCO)C	0.25	0.0
Compound_510	OCC[N+](CC(CC(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)O)(CCO)C	0.25	0.0
Compound_511	OCC[N+](CC(CC(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)(CCO)C	0.25	0.0
Compound_512	CC[N+](CCCNS(=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)C	0.31	0.0
Compound_513	OCCN(S(=O)(=O)c1ccc(cc1)OC(=C(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)CCO	0.56	1.0
Compound_514	O=C(C(C(C(F)(F)F)(F)F)(C(F)(F)F)F)C(F)(F)F	0.82	1.0
Compound_515	FC(C(C(F)(F)F)(C(F)(F)F)F)(S(=O)(=O)OS(=O)(=O)C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)F	0.95	1.0
Compound_516	FC(C(C(C(C(C(S(=O)(=O)[O-])(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)C(F)(F)F	0.98	1.0
Compound_517	CC[N+](CCCNS(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(CC)C	0.27	0.0
Compound_518	CCCCCCCCC=CCCCCCCCCOC(=O)Nc1cc(ccc1C)NC(=O)OCCN(S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C	0.24	0.0
Compound_519	FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(SSC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.89	1.0
Compound_520	FC(C(=C(C(C(F)(F)F)(F)F)C(F)(F)F)C(C(F)(F)F)(Oc1ccc(cc1)S(=O)(=O)[O-])F)(F)F	0.89	1.0
Compound_521	FC(=C(C(C(C(F)(F)F)(F)F)(C(C(F)(F)F)(F)F)C(F)(F)F)C(C(C(F)(F)F)(F)F)(C(F)(F)F)F)Oc1ccc(cc1)S(=O)(=O)[O-]	0.86	1.0
Compound_522	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	0.31	0.0
Compound_523	CCCCOCCOCCOCC(CC(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	0.91	1.0
Compound_524	FC(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)(C(CC1OC1)(F)F)F	0.84	1.0
Compound_525	FC(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)(CC1CO1)F	0.84	1.0
Compound_526	FC(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)(C(C(C(CC1OC1)(F)F)(F)F)(F)F)F	0.84	1.0
Compound_527	OC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)COP(=O)(O)O	0.83	1.0
Compound_528	OCC[N+](CC(CC(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(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)O)(CCO)C	0.2	0.0
Compound_529	OCC[N+](CC(CC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)(CCO)C	0.2	0.0
Compound_530	OCC[N+](CC(CC(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)(CCO)C	0.2	0.0
Compound_531	OC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CNCCCN(C)C	0.04	0.0
Compound_532	OCC(CC(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	0.65	1.0
Compound_533	OC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CN1CC1	0.05	0.0
Compound_534	C=COCC(CC(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	0.88	1.0
Compound_535	[O-]C(=O)CN(CC(CC(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)C	0.03	0.0
Compound_536	CC1(C)OCC(O1)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F	0.9	1.0
Compound_537	OC(CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)COc1ccccc1	0.93	1.0
Compound_538	C=CC(=O)OCC(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	0.99	1.0
Compound_539	CCCCCCCCC=CCCCCCCCCOC(=O)Nc1cc(ccc1C)NC(=O)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	0.31	0.0
Compound_540	FC(C(=C1C(F)(OCCOC1(C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)(F)F	0.25	0.0
Compound_541	OC(=O)C(C(N1C(F)(F)C(F)(F)N(C(C1(F)F)(F)F)C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F	0.01	0.0
Compound_542	FC1(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(C(OC(C(OC1(F)F)(F)F)(F)F)(F)F)(F)F	0.44	0.0
Compound_543	Oc1ccc2c(c1)C[C@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2O)C)CCCCCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F	0.75	1.0
Compound_544	C=CC(=O)OCC(CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O	0.85	1.0
Compound_545	ICCC(C(F)(F)F)(C(F)(F)F)F	0.93	1.0
Compound_546	O=C(C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F	0.97	1.0
Compound_547	OCCCC(C(F)(F)F)(F)F	0.93	1.0
Compound_548	FC(C(C(F)(F)F)(Cl)F)(C(F)(F)F)Cl	0.79	1.0
Compound_549	O=C(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F	0.96	1.0
Compound_550	FC(C(C1(F)OC(C(C1(F)F)(F)F)(F)F)(F)F)(F)F	0.96	1.0
Compound_551	OCC(C(C(F)(F)F)F)(F)F	0.91	1.0
Compound_552	FC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F	0.69	1.0
Compound_553	Cc1cc(Cc2cc(C)c(c(c2)C(C)(C)C)O)cc(c1O)C(C)(C)C	1.0	1.0
Compound_554	Oc1ccc(cc1)C(=C1CCCCC1)c1ccc(cc1)O	0.99	1.0
Compound_555	Oc1ccc(cc1)C(c1ccc(cc1)C(c1ccc(cc1)O)(c1ccc(cc1)O)C)(C)C	1.0	1.0
Compound_556	CC(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C	1.0	1.0
Compound_557	Oc1ccc(c(c1)C)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1C)O	0.96	1.0
Compound_558	Oc1cc(O)c(c(c1)O)C(=O)c1ccc(c(c1)O)O	0.99	1.0
Compound_559	Oc1ccc(cc1c1ccccc1)C(c1ccc(c(c1)c1ccccc1)O)(C)C	1.0	1.0
Compound_560	Oc1ccc(cc1)S(=O)(=O)c1ccccc1O	0.85	1.0
Compound_561	O=C(CC(c1ccc(c(c1)C(C)(C)C)O)(c1ccc(c(c1)C(C)(C)C)O)C)OCCOC(=O)CC(c1cc(C)c(c(c1)C(C)(C)C)O)(c1ccc(c(c1)C(C)(C)C)O)C	0.91	1.0
Compound_562	Oc1ccc(cc1)Cc1ccccc1O	0.99	1.0
Compound_563	Oc1ccc(cc1)C(c1ccccc1O)(C)C	1.0	1.0
Compound_564	Oc1ccc(c(c1)O)Sc1ccc(cc1O)O	0.92	1.0
Compound_565	CC(c1ccc(cc1)O)(c1ccc(cc1)O)c1ccc(cc1)O	0.99	1.0
Compound_566	Oc1ccc(cc1C(C)(C)C)C(c1ccc(c(c1)C(C)(C)C)O)(C)C	1.0	1.0
Compound_567	CCCCCCCCCCCCOCCOCCOCCOS(=O)(=O)[O-]	0.82	1.0
Compound_568	CC(CC(CC(=O)C)C)C	0.8	1.0
Compound_569	CC(OP(=S)(OC(CC(C)C)C)S)CC(C)C	0.78	1.0
Compound_570	O=C(C(=C)C)OCCOP(=O)(OCCOC(=O)C(=C)C)O	0.55	1.0
Compound_571	CCCCOCCCOC(CC)O	0.85	1.0
Compound_572	CC(CCCCCCCOP(=O)([O-])[O-])C	0.99	1.0
Compound_573	[O-]C(=O)CNCO	0.12	0.0
Compound_574	CCCCCC(CSSc1nnc(s1)SSCC(CCCCC)(C)C)(C)C	0.71	1.0
Compound_575	CCCCC(CN(CCC(=O)O)CCC(=O)[O-])CC	0.01	0.0
Compound_576	O=C(c1ccccc1)OCCOCCOCCOC(=O)c1ccccc1	0.96	1.0
Compound_577	CCCC(C(C(=O)O)(CCC)CCC)(C(=O)O)/C=C/C	0.39	0.0
Compound_578	CCCCCCCCCCCCc1c(cccc1S(=O)(=O)[O-])Oc1ccccc1S(=O)(=O)[O-]	0.61	1.0
Compound_579	CCCCCCCCCCCCCCCCCCCCCCCCCCO	0.98	1.0
Compound_580	CCCCCCCCCc1cc2ccccc2c(c1CCCCCCCCC)S(=O)(=O)[O-]	0.77	1.0
Compound_581	CCN(c1ccc2c(c1)[o+]c1c(c2c2ccccc2C(=O)O)ccc(c1)N(CC)CC)CC	0.23	0.0
Compound_582	CCCCCCCCCc1ccccc1OCCOCCOCCOCCOCCOCCOCCOCCOCCOP(=O)(O)O	0.51	1.0
Compound_583	CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC	0.87	1.0
Compound_584	[O-]S(=O)(=O)c1ccc2c(c1)C1=NC2=Nc2[n-]c(c3c2cccc3)N=C2N=C(N=c3[n-]c(=N1)c1ccccc31)c1c2cc(cc1)S(=O)(=O)[O-]	0.96	1.0
Compound_585	CCC1CCCCC1	0.97	1.0
Compound_586	CCCCCCCCCCCCCCC/C=C/C1=NCCN1CCO	0.2	0.0
Compound_587	CC(S(=O)(=O)[O-])(c1ccccc1)C	0.58	1.0
Compound_588	CCCCCCCCCCCC(=O)OCCCCCCCC	0.95	1.0
Compound_589	COCCCN	0.84	1.0
Compound_590	CCCCCCCCCC(SSc1nnc(s1)SSC(CCCCCCCCC)(C)C)(C)C	0.86	1.0
Compound_591	CCCCCCCCCCOCCCN(CCC(=O)O)CCC(=O)[O-]	0.04	0.0
Compound_592	CCCCCCC(C(C)(C)C)CCC(C(C)(C)C)CCc1ccc(cc1)O	0.8	1.0
Compound_593	CCCCCCCCCCCCCC[C@H](c1cccc2c1cccc2)C	0.88	1.0
Compound_594	CCCCN(CCO)CCO	0.94	1.0
Compound_595	NC(=O)NC(=O)N	0.08	0.0
Compound_596	C[C-]1C=CC=C1	0.97	1.0
Compound_597	OCCN1CCN(CC1)CCO	0.22	0.0
Compound_598	CCCCCCCCCCCCc1ccccc1	0.95	1.0
Compound_599	Cc1cc(N=Nc2ccc(cc2)NN=C2C(=O)c3c(N)cc(cc3C=C2S(=O)(=O)[O-])S(=O)(=O)[O-])ccc1NN=C1C(=O)c2c(N)cc(cc2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-]	0.91	1.0
Compound_600	CCCCNc1ccc(c2c1C(=O)c1c(C2=O)cccc1)NCCCC	0.06	0.0
Compound_601	O=C(C(=C)C)OCCOc1ccc(cc1)C(c1ccc(cc1)OCCOC(=O)C(=C)C)(C)C	0.7	1.0
Compound_602	C=CCCCCCCCCCCCCCCCCC1CC(=O)OC1=O	0.93	1.0
Compound_603	C=CCCCCCCC(C(=O)[O-])CC(=O)[O-]	0.49	0.0
Compound_604	CCCCOC(CC)O	0.97	1.0
Compound_605	CCCCCOP(=O)(OCCCCC)O	0.93	1.0
Compound_606	CCCCOC1OC(CO)C(C(C1O)O)O	0.59	1.0
Compound_607	Nc1ccc2c(c1)C=C(C(=NNc1ccc(c3c1cc(cc3)S(=O)(=O)[O-])N=Nc1ccc(c3c1cccc3)N=Nc1cc3c(c(c1)S(=O)(=O)[O-])cccc3S(=O)(=O)[O-])C2=O)S(=O)(=O)[O-]	0.89	1.0
Compound_608	CCCCCCCCS(=O)(=O)[O-]	0.32	0.0
Compound_609	OCCN(CP(=O)(O)O)CP(=O)(O)O	0.32	0.0
Compound_610	CCC(COC(=O)C)C	0.93	1.0
Compound_611	COc1cc(N=Nc2cc(cc3c2c(O)cc(c3)S(=O)(=O)[O-])S(=O)(=O)[O-])c(cc1N=Nc1c(O)c2c(Nc3nc(Nc4ccccc4)nc(n3)Nc3ccc(cc3)N=Nc3ccc(c(c3)C(=O)[O-])O)cc(cc2cc1S(=O)(=O)[O-])S(=O)(=O)[O-])C	0.85	1.0
Compound_612	CCCCCCCCCCCCc1ccc(cc1)N/N=C/1\C=CC(=O)/C(=N/Nc2ccc(cc2)CCCCCCCCCCCC)/C1=O	0.09	0.0
Compound_613	CC(CC(c1ccc2c(c1)cccc2Nc1ccccc1)(C)C)(C)C	0.99	1.0
Compound_614	CC(CC(SSSSC(CC(C)(C)C)(C)C)(CSSSSC(CC(C)(C)C)(C)C)C)(C)C	0.85	1.0
Compound_615	CN(Cc1c(cccc1O)CN(C)C)C	0.05	0.0
Compound_616	COc1cc(c(cc1NC(=O)C(C(=O)C)N=Nc1ccc(cc1)c1nc2c(s1)c(c(cc2)C)S(=O)(=O)[O-])C)S(=O)(=O)[O-]	0.97	1.0
Compound_617	CCCCC(COC(=O)C=CC(=O)O)CC	0.39	0.0
Compound_618	CCCl	0.99	1.0
Compound_619	OCC[n+]1ccc(cc1)C=Cc1ccc(cc1)N(Cc1ccccc1)CC	0.16	0.0
Compound_620	OCC[n+]1ccc(cc1)/C=C/c1ccc(cc1)N(CCc1ccccc1)CC	0.22	0.0
Compound_621	CCCCCCCCCCCCc1ccc(cc1)O	0.97	1.0
Compound_622	CC(SC(C)(C)C)(C)C	0.98	1.0
Compound_623	O=C1CCCCCCCCCC=CCCCO1	0.96	1.0
Compound_624	O(CC1OC1)CC1CCC(CC1)COCC1OC1	0.66	1.0
Compound_625	CCCCCCCCOC(=O)CC(S(=O)(=O)[O-])C(=O)OCCCCCCCC	0.56	1.0
Compound_626	OCCOCCN(CCO)CCO	0.27	0.0
Compound_627	CCCCNc1ccc2c3c1cccc3c(=O)n(c2=O)CCCC	0.06	0.0
Compound_628	CC[N+](=C1C=CC(=C(c2cc(O)c(cc2S(=O)(=O)[O-])S(=O)(=O)[O-])c2ccc(cc2)N(CC)CC)C=C1)CC	0.62	1.0
Compound_629	COCC(OCC(O)C)C	0.85	1.0
Compound_630	CC(C(C(C(S)(C)C)(C)C)(C)C)C	0.98	1.0
Compound_631	CCCCCCCCCCCCCOCCOCCOCCOS(=O)(=O)[O-]	0.82	1.0
Compound_632	[O-]S(=O)(=O)c1c(ccc2c1cccc2)Cc1ccc2c(c1S(=O)(=O)[O-])cccc2	0.59	1.0
Compound_633	OCCN(c1ccc(cc1)C)CCO	0.6	1.0
Compound_634	CCCCCCCCCCc1cccc(c1S(=O)(=O)[O-])Oc1ccccc1S(=O)(=O)[O-]	0.67	1.0
Compound_635	CCCOCC#C	0.98	1.0
Compound_636	CC(=O)OC1=CCC2C1C1CCC2C1	0.93	1.0
Compound_637	Clc1c2C(=NC(=O)c2c(c(c1Cl)Cl)Cl)Nc1ccc(cc1)NC1=NC(=O)c2c1c(Cl)c(Cl)c(c2Cl)Cl	0.05	0.0
Compound_638	CCCCCCCCCCCCc1ccc(cc1)N/N=C/1\C(=O)C=C/C(=N/Nc2ccc(cc2C)C)/C1=O	0.07	0.0
Compound_639	CC(COC(=O)CCCC(=O)OCC(C)C)C	0.96	1.0
Compound_640	CCl	0.96	1.0
Compound_641	CCCCC(CN(Cn1nnc2c1ccc(c2)C)CC(CCCC)CC)CC	0.56	1.0
Compound_642	CCOC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@H]([C@@H]([C@H]2O)OCC)O)[C@@H]([C@H]([C@@H]1O)COCC)O	0.34	0.0
Compound_643	COC[C@H]1O[C@@H](O)[C@@H]([C@H]([C@@H]1O)O)OC(C)C	0.56	1.0
Compound_644	OCCN(c1cccc(c1)C)CCO	0.24	0.0
Compound_645	CC(COC(=O)CCC(=O)OCC(C)C)C	0.96	1.0
Compound_646	O=C(C(=C)C)OCCOCCOCCOCCOC(=O)C(=C)C	0.84	1.0
Compound_647	[O-]c1cc(ccc1N=Nc1c2ccc(cc2cc(c1[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])c1ccc(c(c1)[O-])N=Nc1c2ccc(cc2cc(c1[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	0.99	1.0
Compound_648	CCCCC(CO[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)CC	0.68	1.0
Compound_649	O[P+](=O)CN(=O)(CP(=O)(O)O)CP(=O)(O)O	0.26	0.0
Compound_650	COCCOCCOCCOCCOCCO	0.98	1.0
Compound_651	CCN(c1ccc(cc1)N=Nc1ccccc1)CC	0.5	0.0
Compound_652	Cc1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1	0.98	1.0
Compound_653	OCC(NC)(C)C	0.1	0.0
Compound_654	CCCCCCOC(=O)c1ccccc1C(=O)c1ccc(cc1O)N(CC)CC	0.52	1.0
Compound_655	O[C@@H]1NC(=O)N[C@@H]1O	0.03	0.0
Compound_656	CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)(COC(=O)CCCCCCCC=CCCCCCCCC)CC	0.82	1.0
Compound_657	NC(=O)C(C(=O)N)(Br)Br	0.32	0.0
Compound_658	O=C1N(Cc2ccc3c(c2)c(=O)c2c([nH]3)cc3c(c2)[nH]c2c(c3=O)cccc2)C(=O)c2c1cccc2	0.05	0.0
Compound_659	OC(=O)CCCCCNc1nc(NCCCCCC(=O)O)nc(n1)NCCCCCC(=O)O	0.01	0.0
Compound_660	COP(=O)(O)O	0.34	0.0
Compound_661	NCC(=O)NCC(=O)N[C@@H](C(=O)N[C@H](C(=O)O)CCCN=C(N)N)Cc1ccc(cc1)O	0.01	0.0
Compound_662	OCCOC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@H]([C@@H]([C@H]2O)OCCO)O)[C@@H]([C@H]([C@@H]1O)COCCO)O	0.53	1.0
Compound_663	CCC(OP(=S)(OCCCCCC(C)C)[S-])C	0.94	1.0
Compound_664	CCCCC(CN(Cn1nnc2c1cccc2C)CC(CCCC)CC)CC	0.56	1.0
Compound_665	CC1CCCC1	0.85	1.0
Compound_666	CC(C(C=CC1CC=C(C1(C)C)C)(C)C)O	0.52	1.0
Compound_667	Oc1ccccc1C1CCCCC1	0.98	1.0
Compound_668	CC(=CC=CC=C(C=CC=C(C=CC1=C(C)C[C@H](CC1(C)C)O)C)C)/C=C/C=C(/C=C/[C@H]1C(=C[C@@H](CC1(C)C)O)C)\C	0.02	0.0
Compound_669	CCC(=O)OCC(OC(C1CCCC(C1)(C)C)C)(C)C	0.93	1.0
Compound_670	CC1(C)[C@H]2CC[C@@]3([C@H]1C1(OCCO1)CCC3(C)C)C2	0.13	0.0
Compound_671	OC(COC(=O)C(=C)C)COc1ccc(cc1)C(c1ccc(cc1)OCC(COC(=O)C(=C)C)O)(C)C	0.69	1.0
Compound_672	CC(COCC1OC1)(COCC1OC1)C	0.72	1.0
Compound_673	CCOC(CO)C	0.98	1.0
Compound_674	CCCCCCCCCCCCc1cc(C)cc(c1O)n1nc2c(n1)cccc2	0.11	0.0
Compound_675	CCC(=O)OCC(=O)OC(C1CCCC(C1)(C)C)C	0.85	1.0
Compound_676	O=C1CCCCCCCCCCCCCCC1	0.98	1.0
Compound_677	O=C1c2ccc(cc2C=C(/C/1=N/Nc1ccc(cc1)N=Nc1ccc(cc1)S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)c1ccccc1	0.91	1.0
Compound_678	CC(CCCCCOC(=O)COc1ccc(cc1C)Cl)C	0.93	1.0
Compound_679	CCCCCCCCCc1ccc(cc1)Nc1ccccc1	0.95	1.0
Compound_680	O=C(Nc1ccc2c(c1)ccc(c2O)N=Nc1ccccc1)Nc1ccc2c(c1)cc(c(c2O)N=Nc1ccc(cc1)NC(=O)C)S(=O)(=O)O	0.95	1.0
Compound_681	Nc1cc(cc2c1C(=O)C(=NNc1ccccc1)C(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-]	0.5	0.0
Compound_682	O=C(Nc1cc(ccc1Cl)C(F)(F)F)Cn1cnc(n1)N(=O)=O	0.15	0.0
Compound_683	O=[P+](Oc1ccccc1)Oc1ccccc1	0.99	1.0
Compound_684	C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C	0.74	1.0
Compound_685	CCC(COC(=O)c1ccccc1O)C	0.95	1.0
Compound_686	CC1CC2=C(CC1(C)C(=O)C)CCCC2(C)C	0.95	1.0
Compound_687	OCCOCCOCCOCCOCC	0.98	1.0
Compound_688	O=C1C=Cc2c(/C/1=N\Nc1ccc(cc1C)S(=O)(=O)[O-])cccc2	0.92	1.0
Compound_689	[O-]S(=O)(=O)c1cccc(c1)N=Nc1ccc(cc1)Nc1ccccc1	0.98	1.0
Compound_690	CCCCCCCCCCCCCCCOC(=O)C(=C)C	0.99	1.0
Compound_691	OCC(CCl)Cl	0.85	1.0
Compound_692	Clc1nc(Nc2ccc(cc2)Nc2nc(Cl)nc(n2)Nc2cc(cc3c2C(=O)/C(=N/Nc2ccccc2S(=O)(=O)O)/C(=C3)S(=O)(=O)O)S(=O)(=O)O)nc(n1)Nc1cc(cc2c1C(=O)/C(=N/Nc1ccccc1S(=O)(=O)O)/C(=C2)S(=O)(=O)O)S(=O)(=O)O	0.7	1.0
Compound_693	CC1CC=CCCCCCCCCCC(=O)C1	0.98	1.0
Compound_694	O=C(Nc1ccc2c(c1)C=C(C(=NNc1ccccc1)C2=O)S(=O)(=O)[O-])Nc1ccc2=C(/C(=N\Nc3ccc(cc3)C(=O)[O-])/C(=O)C=c2c1)S(=O)(=O)[O-]	0.93	1.0
Compound_695	O=C1CCCN1C1CCCCC1	0.06	0.0
Compound_696	CN(c1ccc(cc1)C=CC1=[N+](C)c2c(C1(C)C)cccc2)C	0.15	0.0
Compound_697	O=C1C(c2ccc3c(n2)c(cc(c3)S(=O)(=O)O)S(=O)(=O)O)C(=O)c2c1cccc2	0.95	1.0
Compound_698	COC(=O)CCc1cc(c(c(c1)n1nc2c(n1)cccc2)O)C(C)(C)C	0.54	1.0
Compound_699	CNc1ccc(cc1)[C+](c1ccc(cc1)N(C)C)c1ccc(cc1)N(C)C	0.95	1.0
Compound_700	CC(CCCCCCOP(=O)(O)O)C	0.83	1.0
Compound_701	CCN=C1C=CC(=C(c2ccc(c(c2)C)NCC)c2ccc(c(c2)C)NCC)C=C1C	0.6	1.0
Compound_702	CCCCCCCCc1ccc(cc1)Nc1ccc(cc1)CCCCCCCC	0.94	1.0
Compound_703	CCC(C1(C)COC(OC1)C1CCC(=CC1C)C)C	0.45	0.0
Compound_704	C1=CC2C(C=C1)/C/1=N/C3=NC(=Nc4[n-]c(N=C5N=C(N=C2N1)c1ccccc51)c1c4cccc1)c1c3cccc1	0.85	1.0
Compound_705	CCCCCCCCSSc1nnc(s1)SSCCCCCCCC	0.67	1.0
Compound_706	CC(Nc1ccc(c2c1C(=O)c1c(C2=O)cccc1)NC(C)C)C	0.89	1.0
Compound_707	Nc1ccc2c3c1cccc3c(=O)[nH]c2=O	0.04	0.0
Compound_708	NC(=N)S(=O)O	0.18	0.0
Compound_709	CCCCOCCOCCOCCOCCOCCO	0.99	1.0
Compound_710	CC(CC(CCC(CC(C)C)(O)C)(O)C)C	0.38	0.0
Compound_711	OCN1C(O)C(N(C1=O)CO)O	0.03	0.0
Compound_712	OCC1(C)CC1CC1CC2C(C1(C)C)(C2)C	0.28	0.0
Compound_713	C=CC(=O)OCCOC(=O)C=C	0.9	1.0
Compound_714	CCCCCCCCCCCCc1c(cccc1S(=O)(=O)[O-])Oc1cccc(c1CCCCCCCCCCCC)S(=O)(=O)O	0.4	0.0
Compound_715	Cc1cc2ccccc2c(c1C)S(=O)(=O)[O-]	0.79	1.0
Compound_716	CCCCCCCCCCCCCN	0.8	1.0
Compound_717	CCCCCCCCCCCCCCCC=CC1=NC(CO1)(CO)CO	0.11	0.0
Compound_718	O=C1C=CC(=O)N1c1cccc(c1)N1C(=O)C=CC1=O	0.02	0.0
Compound_719	CCCOC(=O)[C@@H](OC(CC)(C)C)C	0.82	1.0
Compound_720	OCC(C[N+](C)(C)C)O	0.02	0.0
Compound_721	CCCC1C(=CC(=CN1c1ccccc1)CC)CC	0.14	0.0
Compound_722	Cc1c(cccc1NC1=NC(=O)c2c1c(Cl)c(Cl)c(c2Cl)Cl)NC1=NC(=O)c2c1c(Cl)c(Cl)c(c2Cl)Cl	0.09	0.0
Compound_723	CCCCCCCCCCCCSSc1n[nH]c(=S)s1	0.68	1.0
Compound_724	CCCCCCCCC=CCCCCCCC=C1OC(=O)C1CCCCCCC=CCCCCCCCC	0.79	1.0
Compound_725	CCN(c1ccc(cc1)C(c1ccc(cc1)N(CC)CC)(c1ccc(cc1)N(CC)CC)O)CC	0.91	1.0
Compound_726	O=C1C=Cc2c(C1=NNc1ccc(cc1)S(=O)(=O)[O-])cccc2	0.93	1.0
Compound_727	CCN(c1ccc(cc1)C=CC1=[N+](C)c2c(C1(C)C)cccc2)CC	0.25	0.0
Compound_728	CCC(C(=O)OC(C)C)C	0.9	1.0
Compound_729	CCCCCCCCCC1=CC(=NNc2ccc(cc2C)c2ccc(c(c2)C)NN=C2C=C(CCCCCCCCC)C=CC2=O)C(=O)C=C1	0.05	0.0
Compound_730	CCCCCCCOC(=O)CCCCCCCCC=C	0.98	1.0
Compound_731	CCCCOP(=S)(OCCCC)[S-]	0.92	1.0
Compound_732	CCOC(=O)C1CCC(CC1)C(=O)OCC	0.94	1.0
Compound_733	CCP(=O)(OCC)OCC	0.99	1.0
Compound_734	CC(CCCCCC(=O)[O-])C	0.63	1.0
Compound_735	Cc1cc(ccc1N/N=C/1\C(=O)C=Cc2c1cccc2)N=Nc1ccccc1C	0.24	0.0
Compound_736	[O-]C(=O)CNCC(=O)[O-]	0.03	0.0
Compound_737	O=C1C(=O)C2(C(C1CC2)(C)C)C	0.69	1.0
Compound_738	CN(CCN1CCN(CC1)C)C	0.07	0.0
Compound_739	OCC(CC(=C)C1CC=C(C1(C)C)C)C	0.11	0.0
Compound_740	OCC(OC(CO)C)C	0.96	1.0
Compound_741	O=C1CCc2c(O1)cccc2	0.96	1.0
Compound_742	CC(COC(=O)C)O	0.83	1.0
Compound_743	CCCCc1oc2c(c1C(=O)c1ccc(cc1)O)ccc(c2)N(=O)=O	0.37	0.0
Compound_744	CN(CCOC(=O)C)C	0.45	0.0
Compound_745	O[C@@H]1CC(=C(C(C1)(C)C)C=CC(=CC=CC(=CC=CC=C(/C=C/C=C(/C=C/C1=C(C)C[C@H](CC1(C)C)O)\C)C)C)C)C	0.02	0.0
Compound_746	C=CC(=O)OCCOCCOCCOC(=O)C=C	0.99	1.0
Compound_747	CC(O[P+](=O)OC(C)C)C	0.97	1.0
Compound_748	c1ccc2c(c1)c1ccc3c4c1c(c2)ccc4c1c(c3)cccc1	1.0	1.0
Compound_749	c1ccc2c(c1)c1c3ccccc3c3c4c1c(c2)ccc4ccc3	1.0	1.0
Compound_750	c1ccc2c(c1)c1ccc3c4c1c(c2)c1ccccc1c4ccc3	1.0	1.0
Compound_751	[O-]C(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C	0.1	0.0
Compound_752	CCCCCCCCCCCCCOC(=O)C(=C)C	0.99	1.0
Compound_753	CCCCc1ccc2c(c1)cc(cc2S(=O)(=O)O)CCCC	0.45	0.0
Compound_754	CCCCCCOCCOCCOCCO	0.98	1.0
Compound_755	CCC(CO)CO	0.77	1.0
Compound_756	Cc1ccc(cc1)OC[C@@H]1OC1	0.98	1.0
Compound_757	C=Cc1ccccc1CC	0.99	1.0
Compound_758	COP(=S)(SC)OC	0.92	1.0
Compound_759	COCN1C(O)C(N(C1=O)COC)O	0.08	0.0
Compound_760	CCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCC(C)C	0.92	1.0
Compound_761	CCCCCCCC(=O)Oc1c(I)cc(cc1I)C#N	0.85	1.0
Compound_762	OCCOCC#C	0.98	1.0
Compound_763	CCCCCCCCCCCCCCCC(=O)NCCNC(=O)CCCCCCCCCCCCCCC	0.41	0.0
Compound_764	CCCCCCC(CCCCCCCCCCC(=O)NCCCCCCNC(=O)CCCCCCCCCCC(CCCCCC)O)O	0.05	0.0
Compound_765	CCCCCCCCCCCCCCCCCCCCCCCCCCCCO	0.98	1.0
Compound_766	CC(=C1CCC(CC1)(C)O)C	0.09	0.0
Compound_767	CN(c1ccccc1C)C	0.85	1.0
Compound_768	O=Cc1cccc(c1Cl)Cl	0.93	1.0
Compound_769	CCC(COC(=O)CCN1CC1C)(COC(=O)CCN1CC1C)COC(=O)CCN1CC1C	0.07	0.0
Compound_770	CCOP(=O)(Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)[O-]	0.97	1.0
Compound_771	COS(=O)(=O)C	0.87	1.0
Compound_772	CC(CCCCCCCCCCCCCCC(=O)OC(C(=O)OC(C(=O)[O-])C)C)C	0.24	0.0
Compound_773	CCCCCCCCCCOC(=O)c1ccc(c(c1)C(=O)OCCCCCCCC)C(=O)OCCCCCCCCCC	0.88	1.0
Compound_774	CC(=O)Nc1cccc(c1)Nc1cc(c(c2c1C(=O)c1ccccc1C2=O)N)S(=O)(=O)[O-]	0.8	1.0
Compound_775	CCN(c1ccc(cc1)/C=C(/C(=O)OCC[N+](C)(C)C)\C#N)Cc1ccccc1	0.04	0.0
Compound_776	CC(=O)CNc1ccc(c(c1)S(=O)(=O)[O-])Nc1cc(c(c2c1C(=O)c1ccccc1C2=O)N)S(=O)(=O)[O-]	0.77	1.0
Compound_777	CCN(c1ccc2c(c1)[o+]c1c(c2c2ccccc2C(=O)OC)ccc(c1)N(CC)CC)CC	0.59	1.0
Compound_778	CCCCCCCCCCOCCCN	0.95	1.0
Compound_779	CCCCCCCCOP(=S)(OCCCCCCCC)SCCC(=O)NCOCNC(=O)CCSP(=S)(OCCCCCCCC)OCCCCCCCC	0.68	1.0
Compound_780	CN(C(=N)N(C)C)C	0.69	1.0
Compound_781	CC1C=CCCCCCCCCCCC(=O)C1	0.98	1.0
Compound_782	CCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCC	0.62	1.0
Compound_783	CCCCNP(=S)(N)N	0.38	0.0
Compound_784	OCCN1CCNCC1	0.18	0.0
Compound_785	CCc1cc(Cc2cc(CC)c(c(c2Cl)CC)N)c(c(c1N)CC)Cl	0.9	1.0
Compound_786	CC(=O)OOC(C)(C)C	0.91	1.0
Compound_787	CCOC(=O)[C@H]1[C@H]2C=C[C@@H]([C@@H]1C(C)C)C2	0.59	1.0
Compound_788	CC(=C)COc1ccc(cc1)S(=O)(=O)O	0.34	0.0
Compound_789	COCCCn1c(=O)c2c(c1=O)c(N)c1c(c2N)c(=O)c2c(c1=O)cccc2	0.02	0.0
Compound_790	CCCCCCC(CCCCCCCCCCC(=O)NCc1cccc(c1)CNC(=O)CCCCCCCCCCC(CCCCCC)O)O	0.07	0.0
Compound_791	O(COCCOc1ccccc1)CCOc1ccccc1	0.99	1.0
Compound_792	SCCOCCOCCS	0.99	1.0
Compound_793	CC=CC=CC=CC=CC=CC=CC=C	0.99	1.0
Compound_794	c1ccc2c(c1)oc(n2)c1ccc(cc1)/C=C/c1ccc(cc1)c1nc2c(o1)cccc2	0.6	1.0
Compound_795	CCCCCCCCCCCC[N+](CCCNC(=O)c1ccc(cc1)N(C)C)(C)C	0.06	0.0
Compound_796	O=N(=O)c1cc(ccc1C)S(=O)(=O)C	0.88	1.0
Compound_797	CCCCCCCCCCCCCCCCOP(=O)(OCCCCCCCCCCCCCCCC)[O-]	0.98	1.0
Compound_798	O=Nc1c([O-])ccc2c1ccc(c2)S(=O)(=O)[O-]	0.98	1.0
Compound_799	OCCOCCOC(=O)c1ccccc1	0.86	1.0
Compound_800	CC[N+](CCOC(=O)C=C)(CC)C	0.38	0.0
Compound_801	CCOCCOC(=O)C(=C)C	0.82	1.0
Compound_802	C=CC(=O)OCC1CCCO1	0.96	1.0
Compound_803	CN(CP(=O)(O)O)CC(=O)O	0.2	0.0
Compound_804	CC(CCOP(=O)(O)O)C	0.74	1.0
Compound_805	Cn1sc2c(c1=O)cccc2	0.52	1.0
Compound_806	CCN(c1ccc(c(c1)C)N)CCNS(=O)(=O)C	0.13	0.0
Compound_807	CC(C(=O)O)CSP(=S)(OCC(C)C)OCC(C)C	0.24	0.0
Compound_808	[O-]C(=O)CCCCCC(C)(C)C	0.43	0.0
Compound_809	CC(=C)C(=O)OCCCO	0.87	1.0
Compound_810	COc1cccc2c1CCC(=O)C2	0.93	1.0
Compound_811	NCCCNC1CCCCC1	0.08	0.0
Compound_812	O=C=NCCCCCCN(C(=O)NCCCCCCN=C=O)C(=O)NCCCCCCN=C=O	0.01	0.0
Compound_813	CCN(c1ccc(cc1)[C+](c1ccc(cc1)N(Cc1cccc(c1)S(=O)(=O)[O-])CC)c1ccc(cc1)N(Cc1cccc(c1)S(=O)(=O)[O-])CC)CC	0.9	1.0
Compound_814	CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC	0.95	1.0
Compound_815	CC(=C)C(=O)OC1CCC(CC1)C(C)(C)C	0.79	1.0
Compound_816	CCCCl	0.98	1.0
Compound_817	CC(C(O)C)Cc1ccccc1	0.43	0.0
Compound_818	CCCCOC(=O)N	0.48	0.0
Compound_819	C=CC(=O)OCC(COC(=O)C=C)(COCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C)CO	0.84	1.0
Compound_820	C=Cc1ccc(cc1)C	0.99	1.0
Compound_821	Clc1ccc(c(c1)N/N=C\1/C(=O)c2c(C=C1S(=O)(=O)[O-])cc(cc2NS(=O)(=O)c1ccc(cc1)C)S(=O)(=O)[O-])Oc1ccccc1	0.78	1.0
Compound_822	CCCCCCCCCCCC(=O)NCCN(CC(=O)[O-])CCOCC(=O)[O-]	0.02	0.0
Compound_823	CCNc1ccc(c2c1C(=O)c1c(C2=O)cccc1)NCC	0.25	0.0
Compound_824	OCCOCCOCC#C	0.98	1.0
Compound_825	O=C(N1CC1)Nc1ccc(cc1)Cc1ccc(cc1)NC(=O)N1CC1	0.15	0.0
Compound_826	CN(C1CCCCC1)C1CCCCC1	0.06	0.0
Compound_827	C[N+]12CN3CN(C2)CN(C1)C3	0.23	0.0
Compound_828	CC(OCCOC(=O)c1ccccc1O)C	0.74	1.0
Compound_829	COS(=O)(=O)c1ccc(cc1)C	0.93	1.0
Compound_830	OCCN(CCOCCN(C)C)C	0.36	0.0
Compound_831	CC(CO[C@H]1[C@H](O)[C@@H](COCC(O)C)O[C@H]([C@@H]1OCC(O)C)O)O	0.46	0.0
Compound_832	OCCN(c1ccccc1)CC	0.51	1.0
Compound_833	CCCC(CCC1C(C)CCC(C1(C)C)C)O	0.57	1.0
Compound_834	CN1CCN(C)CCN(CC1)C	0.39	0.0
Compound_835	O=C(C(=C)C)OCCOc1ccccc1	0.99	1.0
Compound_836	C=CC(=O)OCCCCOC(=O)C=C	0.93	1.0
Compound_837	CCOP(=S)(OCC)OCC	0.92	1.0
Compound_838	CCOC(=O)C(Cc1ccc(c(c1)n1nc(n(c1=O)C(F)F)C)F)(Cl)Cl	0.12	0.0
Compound_839	CCCCCCCCC1OC1CCCCCCCC(=O)OCC(CCCC)CC	0.91	1.0
Compound_840	Oc1ccc(cc1)C1(OS(=O)(=O)c2c1cccc2)c1ccc(cc1)O	0.98	1.0
Compound_841	CCCCCCCCN(CCO)CCO	0.93	1.0
Compound_842	COc1ccc(cc1)CC1CC1	0.93	1.0
Compound_843	CCCCCCCCCCCCCCCCCCCCCC(=O)NC1CCCCC1	0.76	1.0
Compound_844	COc1cc(C=O)ccc1OC(=O)C(C)C	0.76	1.0
Compound_845	O=C(c1ccccc1)c1ccc(cc1)c1ccccc1	0.76	1.0
Compound_846	O=C(c1ccccc1)Oc1ccc(cc1)Cc1ccccc1	0.99	1.0
Compound_847	CCC[NH+]1CCC(=O)CC1	0.36	0.0
Compound_848	OC(=O)CCOC(=O)C=C	0.54	1.0
Compound_849	CCCCCCCCC=CCCCCCCCC(=O)OC(=O)CCCCCCCC=CCCCCCCCC	0.52	1.0
Compound_850	CCCCCCCCCC/C=C/C1CC(=O)OC1=O	0.8	1.0
Compound_851	CC(COC(=O)c1ccc2c3c1cccc3c1c3c2cccc3c(cc1)C(=O)OCC(C)C)C	0.8	1.0
Compound_852	NCCC(CC(CN)C)(C)C	0.15	0.0
Compound_853	CC([NH2+]Cc1ccccc1)(C)C	0.15	0.0
Compound_854	COc1ccc2c(c1)[nH]c(=S)[nH]2	0.52	1.0
Compound_855	CC(COC(=O)c1ccccc1)O	0.96	1.0
Compound_856	ClCCCC(=O)c1ccc(cc1)F	0.93	1.0
Compound_857	CCCCCCCCCCCCCCCCCCN(C(C(=O)[O-])CC(=O)[O-])C(=O)CC(S(=O)(=O)[O-])C(=O)[O-]	0.33	0.0
Compound_858	C=CC(=O)OCCOCCOC(=O)C=C	0.99	1.0
Compound_859	OCC(Oc1ccccc1)C	0.98	1.0
Compound_860	CC=CC(=C)C1C(=CCCC1(C)C)C	0.64	1.0
Compound_861	OS(=O)(=O)CCN1CCOCC1	0.05	0.0
Compound_862	O=C1CC(=O)NC(=S)N1	0.07	0.0
Compound_863	CCCCCCCCCCCCCCCCC(=O)O	0.91	1.0
Compound_864	O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O)C)C	0.12	0.0
Compound_865	CCN(c1ccc2c(c1)Oc1c(C32OC(=O)c2c3cccc2)ccc(c1)N(CC)CC)CC	0.47	0.0
Compound_866	CN(CCCNC(=O)NCCCN(C)C)C	0.19	0.0
Compound_867	[O-]C(=O)CNCCNCC(=O)[O-]	0.04	0.0
Compound_868	COc1ccccc1C	0.96	1.0
Compound_869	CCN(c1ccc(cc1)C)CC	0.58	1.0
Compound_870	CCCCNC(=O)OCCOC(=O)C=C	0.65	1.0
Compound_871	CC(C1CCC(CC1)C(O)C)C	0.33	0.0
Compound_872	O=C1c2ccccc2C(=O)c2c1c(Nc1ccccc1)cc(c2N)S(=O)(=O)[O-]	0.95	1.0
Compound_873	Nc1ccc(c(c1)N)N=Nc1ccc2c(c1)C(=O)C(=NNc1ccc(cc1)Nc1ccc(cc1S(=O)(=O)[O-])N/N=C\1/C(=O)c3cc(N=Nc4ccc(cc4N)N)ccc3C=C1S(=O)(=O)[O-])C(=C2)S(=O)(=O)[O-]	0.67	1.0
Compound_874	CCCCCCCCCCCCCCCCc1c(cccc1S(=O)(=O)[O-])Oc1ccccc1S(=O)(=O)[O-]	0.61	1.0
Compound_875	O=C(C(=C)C)OCCCCCCOC(=O)C(=C)C	0.82	1.0
Compound_876	COc1ccccc1NN=C1C(=O)c2c(NC(=O)C)cc(cc2C=C1S(=O)(=O)O)S(=O)(=O)O	0.6	1.0
Compound_877	O=C(c1ccccc1)OCC(C(C(C)C)OC(=O)c1ccccc1)(C)C	0.92	1.0
Compound_878	O=c1c2cccc3c2c(c2n1c1cccc4c1c(n2)ccc4)ccc3	0.04	0.0
Compound_879	C=CC1(C)C=CC(CC1C(=C)C)C(C)C	0.89	1.0
Compound_880	O=C(C(=O)NCCOC(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)NCCOC(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C	0.02	0.0
Compound_881	C=COCCOCCOCCOC=C	0.98	1.0
Compound_882	Cc1cc(Cc2cc(C)cc(c2O)C2(C)CCCCC2)c(c(c1)C1(C)CCCCC1)O	0.3	0.0
Compound_883	CCCCNC(=O)Nc1ccc(cc1)Cc1ccc(cc1)NC(=O)NCCCC	0.35	0.0
Compound_884	OCC(CO)(CO)C	0.43	0.0
Compound_885	O=Cc1ccc(cc1)B(O)O	0.79	1.0
Compound_886	Cl/C=C/CO/N=C(/C1=C(O)CC(CC1=O)CC(SCC)C)\CC	0.91	1.0
Compound_887	O=Cc1ccccc1S(=O)(=O)[O-]	0.27	0.0
Compound_888	O=c1oc(nc2c1cccc2)c1ccccc1NS(=O)(=O)c1ccc2c(c1)cccc2	0.19	0.0
Compound_889	CCCCCCCCC=CCCCCCCCC(=O)OCCN(CCO)CCO	0.76	1.0
Compound_890	O=Nc1ccc(cc1)N=O	0.97	1.0
Compound_891	NCCCNCCNCCCN	0.11	0.0
Compound_892	CC(CC(=NCCNCCN=C(CC(C)C)C)C)C	0.31	0.0
Compound_893	ClC(=O)OCCOCCOC(=O)Cl	0.96	1.0
Compound_894	COC(CC(=O)C)(C)C	0.91	1.0
Compound_895	Cc1nn(c(c1N=Nc1cc(Cl)c(cc1S(=O)(=O)O)Cl)N)c1cccc(c1)S(=O)(=O)O	0.67	1.0
Compound_896	OS(=O)(=O)c1cc(Nc2nc(Cl)nc(n2)Nc2ccc(cc2)S(=O)(=O)CCOS(=O)(=O)O)c2c(c1)cc(c(c2O)N=Nc1ccc(cc1)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O	0.93	1.0
Compound_897	NC(=O)C(C#N)Br	0.89	1.0
Compound_898	CCC(C(=O)c1ccc(cc1)N1CCOCC1)(N(C)C)Cc1ccc(cc1)C	0.09	0.0
Compound_899	OC(=O)c1cccc(c1)N(=O)=O	0.85	1.0
Compound_900	NCCCN1CCOCC1	0.06	0.0
Compound_901	C=CCNCC=C	0.57	1.0
Compound_902	CCCCCCCCCCOP(Oc1ccccc1)OCCCCCCCCCC	0.99	1.0
Compound_903	OCC1(C)CN(NC1=O)c1ccccc1	0.02	0.0
Compound_904	C=CC12CCN(CC1)C(C2)C(c1ccnc2c1cc(OC)cc2)O	0.03	0.0
Compound_905	CN=C1C=CC(=C(c2ccc(cc2)N(C)C)c2ccc(cc2)N(C)C)C=C1	0.74	1.0
Compound_906	FCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F	0.57	1.0
Compound_907	Clc1ccc(c2c1C(=O)/C(=C\1/Sc3c(C1=O)c(Cl)ccc3Cl)/S2)Cl	0.83	1.0
Compound_908	NCCCCCCNC(=O)O	0.17	0.0
Compound_909	NCCCCCCNCCCCCCN	0.83	1.0
Compound_910	[NH3+]C[C@]1(C)CCC[C@]2([C@H]1CCc1c2ccc(c1)C(C)C)C	0.08	0.0
Compound_911	CC(c1ccc(cc1)Nc1ccc(cc1)C(CC(C)(C)C)(C)C)(CC(C)(C)C)C	0.99	1.0
Compound_912	C=CC1=C(C)C2=NC1=Cc1[n-]c(c(c1C)C=C)C=C1N=C(C=c3[n-]c(=C2)c(C)c3CCC(=O)O)C(=C1C)CCC(=O)O	0.04	0.0
Compound_913	CC(=O)c1cc2c(o1)cccc2	0.98	1.0
Compound_914	O=C=Nc1ccc(cc1)Cc1ccc(cc1)N1C(=O)N(C1=O)c1ccc(cc1)Cc1ccc(cc1)N=C=O	0.06	0.0
Compound_915	CC(c1ccc(cc1)OP(=O)(O)O)(c1ccc(cc1)OP(=O)(O)O)C	0.47	0.0
Compound_916	Oc1ccc(c2c1C(=O)c1c(C2=O)c(ccc1O)N(=O)=O)Nc1ccccc1	0.94	1.0
Compound_917	CCC(CC(CC(CCc1ccc(cc1)O)C)C)C	0.35	0.0
Compound_918	O(CC1OC1)CC1OC1	0.87	1.0
Compound_919	C=CC(=O)OCc1ccccc1	0.98	1.0
Compound_920	CCCCCCOC(=O)C=C	0.99	1.0
Compound_921	CCCCOP(=O)(Oc1ccccc1)OCCCC	0.97	1.0
Compound_922	CC(CCCCCOC(=O)CCCCCCCC(=O)OCCCCCC(C)C)C	0.66	1.0
Compound_923	CC1CN(NC1=O)c1ccccc1	0.09	0.0
Compound_924	c1ccc2c(c1)occ2	0.99	1.0
Compound_925	CCCCOP(=O)(Oc1ccccc1)Oc1ccccc1	0.98	1.0
Compound_926	CCCCCCCCCCCCCCCCCCS	0.98	1.0
Compound_927	CC(=O)c1cc(OCc2ccccc2)cc(c1)OCc1ccccc1	0.99	1.0
Compound_928	CCCCC(CNc1ccc(c2c1C(=O)c1ccccc1C2=O)NCC(CCCC)CC)CC	0.06	0.0
Compound_929	Brc1cc(O)c2c(c1N)C(=O)c1c(C2=O)c(N)ccc1O	0.97	1.0
Compound_930	CCCCCCCCCCCCCC/C=C/C1CC(=O)OC1=O	0.8	1.0
Compound_931	CC1=CC(=C(c2ccc(c(c2)C)N)c2ccc(c(c2)C)N)C=CC1=[NH2+]	0.88	1.0
Compound_932	SCCC(=O)OCC(COC(=O)CCS)(COC(=O)CCS)CC	0.6	1.0
Compound_933	O=C(S(=O)(=O)[O-])NCCCCCCNC(=O)S(=O)(=O)[O-]	0.06	0.0
Compound_934	C=CC(=O)OCCn1c(=O)n(CCOC(=O)C=C)c(=O)n(c1=O)CCOC(=O)C=C	0.03	0.0
Compound_935	CCN(c1ccc(c(c1)NC(=O)C)N=Nc1c(C#N)cc(cc1C#N)N(=O)=O)CC	0.75	1.0
Compound_936	CCCCCCCCCC(OS(=O)(=O)[O-])CCCCCCCC(=O)OCCCC	0.86	1.0
Compound_937	[O-]C(=O)[C@@H](CCCC)C	0.7	1.0
Compound_938	CC(C)(C)C	0.98	1.0
Compound_939	COc1ccc(c(c1)N(=O)=O)N/N=C/1\C(=O)C=Cc2c1cccc2	0.74	1.0
Compound_940	OCCc1ccc(cc1)N(C)C	0.48	0.0
Compound_941	Cc1ccc(c(c1)C)S(=O)(=O)c1ccc(cc1C)C	0.9	1.0
Compound_942	N#CCCN(c1ccc(cc1)N=Nc1c(Cl)cc(cc1Cl)N(=O)=O)CCOC(=O)C	0.77	1.0
Compound_943	CCCCCCCCN(CCC(=O)O)CCC(=O)O	0.08	0.0
Compound_944	CNc1ccc2c(c1)[s+]c1c(n2)ccc(c1)N(C)C	0.86	1.0
Compound_945	N#CC(=Cc1ccc(cc1C)N(CCOc1ccc(cc1)C1CCCCC1)CC)C#N	0.52	1.0
Compound_946	OCCCCCCCCCCCCO	0.97	1.0
Compound_947	CCCCCCCCCc1ccc(c(c1)CN(CC(=O)[O-])C)O	0.02	0.0
Compound_948	OC(=O)c1[nH]cnc1C(=O)O	0.03	0.0
Compound_949	CCCCCCCCCCCCCCCCCC(=O)CC(=O)c1ccccc1	0.87	1.0
Compound_950	N#CC1=C(C)C(=NNc2cccc(c2)OS(=O)(=O)c2ccccc2)C(=O)N(C1=O)C	0.38	0.0
Compound_951	COC(=O)c1ccccc1C(=O)c1ccccc1	0.98	1.0
Compound_952	CCN(C=O)CC	0.81	1.0
Compound_953	OCCN(c1ccc(cc1)N=Nc1ccccc1C(=O)O)CCO	0.02	0.0
Compound_954	COCCOCCCn1c(=O)c2c(c1=O)c(N)c1c(c2N)c(=O)c2c(c1=O)cccc2	0.01	0.0
Compound_955	Cc1ccc(c(c1)N(=O)=O)N/N=C/1\C(=O)C(=Cc2c1cccc2)C(=O)Nc1ccccc1C	0.4	0.0
Compound_956	CCCCC(C(=O)OC(C)C)CC	0.88	1.0
Compound_957	CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)(C)C	0.69	1.0
Compound_958	OC1C[C@@H](C)[C@@]2(C(=C1)C)CCC(=C(C)C)C2	0.19	0.0
Compound_959	CCCCc1ccc(cc1)Nc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)Nc1ccc(cc1)CCCC	0.81	1.0
Compound_960	CCCCCCCCCCCCOC(=O)Nc1ccc(c(c1)N=NC1C(=NN(C1=O)c1cc(Cl)c(cc1Cl)S(=O)(=O)[O-])C)S(=O)(=O)[O-]	0.86	1.0
Compound_961	S=c1[nH]nc(s1)SSc1n[nH]c(=S)s1	0.59	1.0
Compound_962	CCOCCOCCOC(=O)C=C	0.98	1.0
Compound_963	c1ccc(cc1)Nc1ccc(cc1)Nc1ccccc1	0.99	1.0
Compound_964	CC#C	0.96	1.0
Compound_965	C=CC(=O)OCCOCC(COCCOC(=O)C=C)(COCCOC(=O)C=C)CC	0.99	1.0
Compound_966	CC(OCC1OC1)(C)C	0.79	1.0
Compound_967	O=N(=O)c1ccc(cc1)/N=N/c1c(N)c2c(cc1S(=O)(=O)[O-])cc(c(c2O)/N=N/c1ccccc1)S(=O)(=O)[O-]	0.98	1.0
Compound_968	CCCCCCCCSSCCCCCCCC	0.98	1.0
Compound_969	CCc1cc(CC)cc2c1sc1ccccc1c2=O	0.92	1.0
Compound_970	[O-]S(=O)(=O)c1cccc(c1)S(=O)(=O)[O-]	0.82	1.0
Compound_971	Cc1ccc(cc1)c1[nH]c(=O)c2c1c(=O)[nH]c2c1ccc(cc1)C	0.13	0.0
Compound_972	S=c1nn[nH]n1c1ccccc1	0.69	1.0
Compound_973	O=Cc1ccc(cc1Cl)Cl	0.97	1.0
Compound_974	O=C1CCN(N1)c1ccccc1	0.02	0.0
Compound_975	NCCOCCOCCN	0.69	1.0
Compound_976	CCN1CCOCC1	0.53	1.0
Compound_977	OCC[NH+](Cc1ccccc1)C	0.22	0.0
Compound_978	CCNc1cccc(c1)C	0.66	1.0
Compound_979	CCCCOP(OCCCC)OCCCC	0.98	1.0
Compound_980	CC(C#CC(OOC(C)(C)C)(C)C)(OOC(C)(C)C)C	0.93	1.0
Compound_981	CC(CC(C)C)C	0.84	1.0
Compound_982	CCCCCCOC(=O)CCCCCCCC(=O)OCCCCCC	0.8	1.0
Compound_983	CN(CCN(C)C)C	0.22	0.0
Compound_984	CCCC=NO	0.55	1.0
Compound_985	CCCCCCCCCCCCCCCC(=O)OCCCC	0.95	1.0
Compound_986	S=C(N1CCCCC1)SSSSC(=S)N1CCCCC1	0.64	1.0
Compound_987	C=CC(=O)Cc1c(cc(cc1C(CC)(C)C)C(CC)(C)C)C(c1cc(cc(c1O)C(CC)(C)C)C(CC)(C)C)C	0.86	1.0
Compound_988	CCN(c1ccc2c(c1)oc1c(c2c2ccccc2C(=O)O)ccc(=[N+](CC)CC)c1)CC	0.11	0.0
Compound_989	CCCCCCCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCCCCCC	0.63	1.0
Compound_990	CCCCN1C(=O)c2c(C1=O)cccc2	0.34	0.0
Compound_991	OC(=O)c1cccc(c1)S(=O)O	0.6	1.0
Compound_992	CCCCCC#CC=CC=C	0.98	1.0
Compound_993	OCCOP(=O)(O)O	0.56	1.0
Compound_994	CC(=O)CC(S)(C)C	0.91	1.0
Compound_995	CCCCCCCCCc1cc(CN(CCO)CCO)c(c(c1)CN(CCO)CCO)O	0.12	0.0
Compound_996	CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC	0.8	1.0
Compound_997	OC(=O)C(CC(=O)O)(CC(=O)O)O	0.02	0.0
Compound_998	CCOC(=O)c1ccccc1c1c2ccc(cc2[o+]c2c1ccc(c2)N(CC)CC)N(CC)CC	0.43	0.0
Compound_999	CC(C1=CC(=O)C(=CC1=O)C(C)(C)C)(C)C	0.89	1.0
Compound_1000	CNc1ccc(c2c1C(=O)c1ccccc1C2=O)NC	0.92	1.0