Index	SMILES	Probability	Label
Compound_1	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)[C@@](CS(=O)(=O)C)(O)C	0.14	0.0
Compound_2	O=C(c1cnn2c1nccc2)Nc1cc2cn(c(c2cc1N1CCOCC1)O)CC1CCOCC1	0.01	0.0
Compound_3	O[C@@H]1C[C@H](C1)NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C(F)(F)F)C)cc1C(F)F)C(=O)N1CCC[C@@H]1C	0.0	0.0
Compound_4	O=C(N1CCCc2c1ccc(c2)N(S(=O)(=O)c1cccc2c1ccn2C)CC(F)(F)F)c1cccs1	0.42	0.0
Compound_5	COc1nc2ccc(cc2c(c1C1CCCC1)Cl)C(c1cnc(n1C)C)(c1cnnn1C)O	0.61	1.0
Compound_6	N#Cc1cc(ccc1OC)C(=O)Nc1cnc2c(c1C)c(cn2C)C1[C@@H]2CC[C@H]1CN(C2)C(=O)C1CCCC1	0.02	0.0
Compound_7	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1cnn(c1)CCS(=O)(=O)C)F	0.38	0.0
Compound_8	O=C(C1CCN(C(=O)C1)C)N[C@@H]1CC[C@](CC1)(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1c(F)cccc1F)S(=O)(=O)c1ccc(cc1)F	0.28	0.0
Compound_9	CC(=O)N1CCN(CC1)c1ccc(c(c1)F)CN(S(=O)(=O)c1ccc(cc1)C(C)C)C1CCC1	0.26	0.0
Compound_10	O=C(NS(=O)(=O)c1ccccc1F)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C	0.07	0.0
Compound_11	OCC(c1ncc(cn1)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.02	0.0
Compound_12	COc1nc2ccc(cc2c(c1OCC(F)(F)F)C#N)[C@@](c1cncn1C)(c1ccc(nc1)C(F)(F)F)O	0.22	0.0
Compound_13	CN([C@@H]1CCN(C1)C(=O)C1CCc2c(C1)n(nc2C1=CCC(CC1)(C)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F)C	0.05	0.0
Compound_14	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](Oc2c1c(C)c(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC(C(=O)O)(C)C)Cl	0.1	0.0
Compound_15	O=C1CN(CCN1CCS(=O)(=O)C)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.09	0.0
Compound_16	OC[C@@H](c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)nc(n2CC)C[C@@H]1CC[C@H](CC1)C(F)(F)F	0.03	0.0
Compound_17	C[C@H]1CC(CN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)F)C(=O)N[C@H](C(O)(C)C)C)(F)F	0.02	0.0
Compound_18	O=C1CC2(N1)CCN(CC2)C(=O)C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.17	0.0
Compound_19	CC(N(C(=O)C1CCc2c(C1)n(nc2c1ccc(cc1F)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F)C)c1cc[nH]n1	0.06	0.0
Compound_20	Clc1cccc(c1C(=O)c1cn(c2c1cccc2)c1ccc(c(c1F)F)C(=O)O)Cl	0.4	0.0
Compound_21	CC(Cc1ccc(cc1)c1onc(c1C1CC1)C(CC(=O)Nc1ccc(cc1Cl)C)CCC(=O)O)C	0.03	0.0
Compound_22	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)OC(F)(F)F)NC(=O)OC(C(F)(F)F)(C)C	0.16	0.0
Compound_23	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)(F)F)c1sc(nc1C(=O)N1C2CCC1CC2)C(=O)N[C@@H]1COC[C@H]1O	0.0	0.0
Compound_24	FC(c1cc(=NC(C2CC2)(C)C)[nH]cc1c1sc(nc1C(=O)N1C2CCC1CC2)C(=O)NCC(O)(C)C)F	0.01	0.0
Compound_25	OC(=O)c1ccc(c(c1)F)c1nn(c2c1NCCC2)C(=O)c1c(Cl)cccc1C1CC1	0.02	0.0
Compound_26	C[C@H]1CN(CC[C@H]1n1cnnc1)c1ccc(c(c1)F)CN1[C@@H](C)CC[C@@H](S1(=O)=O)c1ccccc1	0.53	1.0
Compound_27	O=C(c1cnn2c1nccc2)Nc1cc2cn(c(c2cc1C1CC1)O)C(C)C	0.07	0.0
Compound_28	O=C(c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C1(F)CC1)NCC1CCN(CC1)S(=O)(=O)C	0.04	0.0
Compound_29	O=C(N1CC2(C1)CCCO2)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.02	0.0
Compound_30	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)c1ccc(s1)Cl)S(=O)(=O)c1ccc(cc1)F	0.21	0.0
Compound_31	FC(Oc1cc(ccc1c1n(C)nc(c1Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C)CC(C(F)(F)F)(C)C)F	0.09	0.0
Compound_32	OC[C@@H](c1ccc(cn1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)cc(n2CC)Cc1ccc(cc1)C(F)(F)F	0.03	0.0
Compound_33	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1CC1)S(=O)(=O)c1ccc(cc1)F	0.09	0.0
Compound_34	COc1ccc2c(n1)CCN(C2C(=O)Nc1cc(F)c(c(c1)F)[Si](C)(C)C)C(=O)CCCC(=O)O	0.02	0.0
Compound_35	COc1cc(CCC(F)(F)F)ccc1c1n(CC)nc(c1C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.11	0.0
Compound_36	CC(C(C(=O)N1CCC(CC1)c1cn(c2c1cc(cc2)NS(=O)(=O)c1ccc(cc1)F)C)C)C	0.39	0.0
Compound_37	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(c(c1)F)OC(c1ccc(cc1Cl)Cl)(C)C	0.86	1.0
Compound_38	Fc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c(cn2C)[C@H]1CCN([C@H](C1)C)C(=O)C1CCCC1	0.26	0.0
Compound_39	COc1nc2ccc(cc2c(c1CN1CCC(CC1)(F)F)Cl)C(c1cnnn1C)(c1ccc(nc1C)C)O	0.13	0.0
Compound_40	CCc1sc(c(n1)S(=O)(=O)N1C[C@H](CCC(=O)O)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)OC(C)C	0.06	0.0
Compound_41	OC(=O)CC1CCN(CC1)C(=O)c1ccc(c(c1Cl)Cn1ccc2c1ccc(c2)C(F)(F)F)Cl	0.07	0.0
Compound_42	Brc1cnc(o1)c1ccc2c(c1)n(nc2c1ccc(cc1F)C(=O)O)C(=O)c1c(Cl)cccc1C(F)(F)F	0.53	1.0
Compound_43	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(c(c1)Cl)F	0.09	0.0
Compound_44	COc1nn2c(c1S(=O)(=O)N1C[C@H](CC(C(=O)O)C)Oc3c1cc(cc3)NC(=O)OC(C(F)(F)F)(C)C)CCCC2	0.04	0.0
Compound_45	OCC1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)c1c(Cl)cccc1Cl	0.07	0.0
Compound_46	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(c(c1)Cl)c1ccccc1Cl	0.67	1.0
Compound_47	FC(Oc1cc(CCCC(F)(F)F)ccc1c1n(C)nc(c1Cl)C(=O)NC[C@]1(O)CC[C@H](C[C@H]1O)S(=O)(=O)C)F	0.03	0.0
Compound_48	OC[C@@H](Cn1nnc(c1)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.02	0.0
Compound_49	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)c1cnn(c1C)C(F)F)S(=O)(=O)c1ccc(cc1)F	0.09	0.0
Compound_50	Fc1cc(C(=O)O)c(cc1c1nn(c2c1c(F)ccc2)Cc1c(cccc1C(F)(F)F)C(C)C)O	0.13	0.0
Compound_51	O=C(c1nc(sc1c1c[nH]c(=N[C@H](C(F)(F)F)C2CC2)cc1C(F)F)C(=O)NC1CCS(=O)(=O)CC1)N1C2CCC1CC2	0.05	0.0
Compound_52	N#CC1(CC1)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cn(nc1Cl)CC)NC(=O)OC(C(F)(F)F)(C)C	0.21	0.0
Compound_53	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N[C@@H]1CC[C@H]1O	0.01	0.0
Compound_54	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1CCN1)S(=O)(=O)c1ccc(cc1)F	0.05	0.0
Compound_55	Fc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c(cn2C)[C@@H]1CCN(C(C1)(C)C)C(=O)C1CCCC1	0.21	0.0
Compound_56	CC(CN(S(=O)(=O)Cc1ccccc1)Cc1ccc(cc1)N1CC2(C1)COCC2)C	0.21	0.0
Compound_57	CC(N(S(=O)(=O)Cc1ccccc1)Cc1ccc(cc1)N1CCN(CC1)C(=O)C)C	0.23	0.0
Compound_58	OC(=O)c1ccc(c(c1)F)c1nn(c2c1nccc2)C(=O)c1c(C)cccc1C1(CC1)C(F)(F)F	0.28	0.0
Compound_59	CC(CC(=O)N[C@@H]1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)O	0.1	0.0
Compound_60	COc1nc2ccc(cc2c(c1CN1CCn2c(C1)nc(n2)C(F)(F)F)Cl)[C@@](c1cncn1C)(c1ccnc(c1)C(F)(F)F)O	0.12	0.0
Compound_61	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CNS(=O)(=O)C2CC2)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)OC(F)F	0.03	0.0
Compound_62	CCCN(Cc1ccc(cc1)C(F)(F)F)Cc1ccc(cc1)NC(=O)Cc1ccc(cc1)S(=O)(=O)CC	0.22	0.0
Compound_63	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cnc2n1cccc2)NC(=O)OC(C(F)(F)F)(C)C	0.07	0.0
Compound_64	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1CCO1)S(=O)(=O)c1ccc(cc1)F	0.13	0.0
Compound_65	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)CC1CCCCO1)S(=O)(=O)c1ccc(cc1)F	0.12	0.0
Compound_66	COc1cc(ccc1c1n(CC)nc(c1C(C)C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C)N[C@@H](C(F)(F)F)C	0.1	0.0
Compound_67	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC2(C)CCC2)cc1C(F)F)C(=O)NCC(O)(C)C	0.01	0.0
Compound_68	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(CC(O2)C(=O)C(F)(F)F)S(=O)(=O)c1ccc(cc1)F	0.48	0.0
Compound_69	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)c1c[nH]nc1)S(=O)(=O)c1ccc(c(c1)Cl)F	0.08	0.0
Compound_70	CCn1nc(c(c1c1ccc(cc1OC(F)F)C[C@H](C(F)(F)F)C)C)C(=O)NC[C@@]1(O)CC[C@@H](C[C@@H]1O)S(=O)(=O)C	0.04	0.0
Compound_71	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N[C@@H](CO)C	0.02	0.0
Compound_72	CCn1nc(c(c1c1ccc(cc1OC(F)F)CCC(F)(F)F)C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.1	0.0
Compound_73	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)c1ccccc1	0.19	0.0
Compound_74	N#Cc1cc(ccc1F)C(=O)Nc1cnc2c(c1C(F)(F)F)c(cn2C)C1CCN(CC1)C(=O)C1CCCC1	0.01	0.0
Compound_75	COc1ccc2c(c1)CCN(C2C(=O)Nc1cc(F)c(c(c1)F)[Si](C)(C)C)C(=O)CC(CC(=O)O)(O)C	0.06	0.0
Compound_76	CCn1nc(c(c1c1c[nH]c(=NC(CC(F)(F)F)(C)C)cc1OC(F)F)Cl)C(=O)NC[C@]1(O)CC[C@H](C[C@H]1O)S(=O)(=O)C	0.02	0.0
Compound_77	O=COC(Cc1nnc(s1)c1nc(c(s1)c1ccc(c(c1Cl)Cl)S(=O)(=O)N[C@H](C(F)(F)F)C)CC1CCC1)(C)C	0.53	1.0
Compound_78	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](Oc2c1cc(cc2)N(C(C(F)(F)F)(C)C)C(=O)O)CC1(CC1)C(=O)N)Cl	0.05	0.0
Compound_79	FC1CN(C1)C1CN(C1)C(=O)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(ccc(c1Cl)F)C1CC1	0.02	0.0
Compound_80	COc1nc2ccc(cc2c(c1CC(F)(F)F)Cl)C(c1cncn1C)(c1ccc(cc1)C#N)O	0.5	0.0
Compound_81	CC(Cc1onc(n1)c1onc(c1C1CC1)C(CC(=O)Nc1ccc(cc1Cl)C)CCC(=O)O)C	0.02	0.0
Compound_82	CC(=O)N=c1cc(n([nH]1)C(C1CC1)C)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.03	0.0
Compound_83	CC(=O)N=c1cc(n([nH]1)C(C)C)c1ccc(c(c1)OCC1CCC1)N(C(=O)c1c(F)cccc1Cl)C	0.02	0.0
Compound_84	OC(=O)CC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1c(Cl)nc2n1ccs2)NC(=O)OC(C(F)(F)F)(C)C	0.07	0.0
Compound_85	O=C(Cc1ccc(cc1)S(=O)(=O)C)Nc1ccc(cc1)CCN1CCOc2c1cc(cc2)OC(C)C	0.44	0.0
Compound_86	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)N1CCC(=O)N1CC(O)(C)C	0.11	0.0
Compound_87	OC[C@@H](c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)cc(n2C1CC1)CN1CCC(CC1)C(F)(F)F	0.1	0.0
Compound_88	CC([C@@H]1N(Cc2ccc(c(n2)C)Cl)Cc2c1[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)C)s2)C	0.05	0.0
Compound_89	O[C@H]1CC[C@@H](C1)NC(=O)c1nc(c(s1)c1c[nH]c(=N[C@H](C(F)(F)F)C)cc1C(F)F)C(=O)N1CCC[C@@H]1C	0.01	0.0
Compound_90	OC(=O)c1ccc(cc1)c1nn(c2c1cccc2)C(=O)c1c(Cl)cccc1C(F)(F)F	0.5	0.0
Compound_91	Fc1cc(C(=O)O)c(cc1c1nn(c2c1CCCC2)C(=O)c1c(Cl)cccc1C1CC1)O	0.03	0.0
Compound_92	NC(=O)Cn1ncc(c1)c1cccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.15	0.0
Compound_93	Fc1cccc(c1OCc1ccc2c(c1)N(CC2)S(=O)(=O)c1cccc(c1)C(F)(F)F)Cl	0.65	1.0
Compound_94	O=C(NS(=O)(=O)c1cccc(n1)C)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C	0.07	0.0
Compound_95	CCn1nc(c(c1c1c[nH]c(=NC(C(C(F)(F)F)(F)F)(C)C)cc1OC(F)F)Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.01	0.0
Compound_96	CCn1nc(c(c1c1ccc(cc1C)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.34	0.0
Compound_97	N#Cc1cc(O)cc(c1)C(=O)Nc1cnc2c(c1C(F)(F)F)c(cn2C)C1CCN(CC1)C(=O)C(C(C)(C)C)C	0.03	0.0
Compound_98	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cccc(n1)c1c[nH]c(=NS(=O)(=O)C)cn1)F	0.33	0.0
Compound_99	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)c1cn(nc1C(F)(F)F)C)S(=O)(=O)c1ccc(cc1)F	0.06	0.0
Compound_100	OC(=O)c1ccc(cc1)n1cc(c2c1c(F)ccc2)C(=O)c1c(Cl)cccc1C(F)(F)F	0.25	0.0
Compound_101	OC(=O)C(Cc1nnc(o1)c1nc(c(s1)c1ccc(c(c1Cl)Cl)C(C(F)(F)F)(C(F)(F)F)O)CN1CCCC(C1)(F)F)(C)C	0.16	0.0
Compound_102	CCc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)S(=O)(=N)C)NCC1CSC1)CC(C)C	0.08	0.0
Compound_103	CCOc1ccccc1CN1CCc2c1ccc(c2)NC(=O)C1N(CCc2c1ccc(n2)OC)C(=O)CCCC(=O)O	0.01	0.0
Compound_104	O=COC(Cc1nnc(o1)c1nc(c(s1)c1cnc(c2c1cccc2)S(=O)(=O)N[C@H](C(F)(F)F)C)CC1CCCCC1)(C)C	0.23	0.0
Compound_105	COc1nc2ccc(cc2c(c1OCC1CC1(F)F)Cl)C(c1cnnn1C)(c1ccc(nc1C)C)O	0.53	1.0
Compound_106	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N1CC2CC(C1)O2	0.02	0.0
Compound_107	CCN(C(=O)c1ccc(cc1)c1n[nH]cn1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.03	0.0
Compound_108	COCCS(=O)(=O)c1ccc2c(c1)CN(C2C(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)C(=O)CO	0.07	0.0
Compound_109	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CC(NS(=O)(=O)C1CC1)(C)C)S(=O)(=O)c1ccc(c(c1)Cl)F	0.17	0.0
Compound_110	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC1CCN(CC1)S(=O)(=O)C	0.09	0.0
Compound_111	O=C(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C)NOCc1cccnc1	0.06	0.0
Compound_112	COc1nc2ccc(cc2c(c1CN1CC(C1)C(F)(F)F)Cl)[C@@](c1cnc(n1C)C)(c1cnnn1C)O	0.07	0.0
Compound_113	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1sc2c([nH]1)[C@@H](N(C2)Cc1ccc(cc1)c1nnn(n1)C)C(C)C	0.11	0.0
Compound_114	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CC(C(=O)O)C)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.17	0.0
Compound_115	OC(=O)c1ccc(c(c1)F)c1nn(c2c1S(=O)CCC2)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F	0.06	0.0
Compound_116	COc1ccc(cc1S(=O)(=O)N1C[C@H](CCC(=O)O)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C	0.07	0.0
Compound_117	Fc1cc(ccc1CN(S(=O)(=O)Cc1ccccc1)CC(F)(F)F)N1CCN(CC1)S(=O)(=O)C	0.26	0.0
Compound_118	BrN[C@@H]1C[C@@H](CC[C@@]1(O)CNC(=O)c1nn(c(c1Cl)c1ccc(cc1OC(F)F)CC(C(F)(F)F)(C)C)CC)S(=O)(=O)C	0.16	0.0
Compound_119	OC(=O)C(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)c1cccc(c1F)Cl)(C)C	0.33	0.0
Compound_120	COc1nn(c(c1S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC(NC(=O)C)(C)C)C)CC	0.06	0.0
Compound_121	CCN(C(=O)c1c[nH]nc1n1cnnn1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.1	0.0
Compound_122	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CC(=O)C(O)O)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)Cl	0.08	0.0
Compound_123	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)O[C@H](C(C(F)(F)F)(F)F)C	0.46	0.0
Compound_124	Clc1cccc(c1C(=O)c1nn(c2c1cccc2)c1ccc(cc1)C(=O)O)Cl	0.55	1.0
Compound_125	CC(CN(S(=O)(=O)Cc1ccccc1)Cc1ccc(cc1)N1CCC2(C1)CCCO2)C	0.17	0.0
Compound_126	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)NCC(C(F)(F)F)O	0.01	0.0
Compound_127	CCS(=O)(=O)c1ccc(nc1)CNC(=O)c1ccc(cc1)CCN1CCOc2c1cc(cc2)CC(C)C	0.1	0.0
Compound_128	CNS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C1(F)CC1	0.03	0.0
Compound_129	CCS(=O)(=O)c1ccc(cc1)[C@@H](NC(=O)c1ccc2c(c1)nc(n2C1CC1)C[C@@H]1CC[C@H](CC1)C(F)(F)F)COC(=O)N	0.02	0.0
Compound_130	FC([C@H]1CC[C@@H](S(=O)(=O)N1Cc1cc(F)c(cc1F)N1CCC(CC1)n1cnnc1)c1ccccc1)F	0.53	1.0
Compound_131	OC(=O)CC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cncc(c1)C)NC(=O)OC(C(F)(F)F)(C)C	0.09	0.0
Compound_132	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)CCN1CCCc2c1cc(cc2)C1CC1	0.08	0.0
Compound_133	CCn1nc(c(c1c1c[nH]c(=NC(CC(F)(F)F)(C)C)cc1OC(F)F)C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.02	0.0
Compound_134	C[C@H]1CC[C@@H](S(=O)(=O)N1Cc1cc(F)c(cc1F)N1C[C@@H]2[C@H](C1)C2n1cnnc1)c1ccccc1	0.56	1.0
Compound_135	OC(=O)C1CCN(C1)C(=O)C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.17	0.0
Compound_136	OC(=O)CC1CCN(CC1)C(=O)c1ccc(c(c1Cl)C(=O)n1nc(c2c1c(C)cc(c2)C(F)(F)F)C)Cl	0.04	0.0
Compound_137	N#Cc1cccc(c1)C(=O)Nc1cnc2c(c1C(F)(F)F)c(cn2C)C1CCN(CC1)C(=O)CC1CCCCC1	0.03	0.0
Compound_138	OC(=O)c1ccc(c(c1)F)c1nn(c2c1ccc(c2)N1CCNC1=O)C(=O)c1c(Cl)cccc1C(F)(F)F	0.01	0.0
Compound_139	O=COC(Cc1nnc(o1)c1nc(c(s1)c1ccc(c(c1Cl)Cl)S(=O)(=O)N[C@H](C(F)(F)F)CC)CC(OC)(C)C)(C)C	0.37	0.0
Compound_140	O=C1CCC(CN1)C(=O)N[C@@H]1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.03	0.0
Compound_141	CC(CN(S(=O)(=O)Cc1ccccc1)Cc1ccc(cc1)c1ccc(cc1)S(=O)(=O)C)C	0.6	1.0
Compound_142	C=CCC1C(=O)C(=C[C@@]2([C@@H]1CCc1c2nc(nc1c1ccccc1F)c1ccnc(c1)C1CC1)C)C#N	0.52	1.0
Compound_143	Fc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c(cn2C)[C@@H]1CCN([C@H](C1)C)C(=O)C1CCCC1	0.26	0.0
Compound_144	Clc1ccc(c(c1Cc1cc2c(n1C)cc(cc2C)C(F)(F)F)Cl)C(=O)N1CCC(CC1)S(=O)(=O)C	0.34	0.0
Compound_145	OC[C@@H](c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)cc(n2CC)Cc1ccc(cn1)C(F)(F)F	0.03	0.0
Compound_146	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2CC(C)C)O[C@@H]1CC[C@H](CC1)C(F)(F)F	0.22	0.0
Compound_147	O=C(C1CCc2c(C1)n(nc2c1ccc(cc1F)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F)N1CCc2c(C1)cn[nH]2	0.02	0.0
Compound_148	O[C@@H]1C[C@H](O)CN(C1)C(=O)c1nc(c(s1)c1ccc(cc1OC(C)C)C(C(F)(F)F)(C(F)(F)F)O)C(=O)N1CC(C[C@@H]1C)(F)F	0.09	0.0
Compound_149	N#CCC(=N)/C=C\C(=N)C(=O)N(C[C@@]12CC[C@H](C2(C)C)/C(=C/C(=N)c2c(F)cccc2F)/C1=N)CC	0.05	0.0
Compound_150	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)OC(C(F)(F)F)(C)C	0.13	0.0
Compound_151	C[C@H]1CN(CCC1C(=O)O)C(=O)c1ccc(c(c1Cl)C(=O)c1cc2c(n1C)cc(cc2C)C(F)(F)F)Cl	0.06	0.0
Compound_152	COc1nc2ccc(cc2c(c1CN1CCC(CC1)C(F)(F)F)Cl)[C@@](c1cnc(n1C)C)(c1ccnc(c1)C(F)(F)F)O	0.03	0.0
Compound_153	COc1nn(c(c1S(=O)(=O)N1C[C@H](CNC(=O)C)Oc2c1cc(cc2)NC(=O)OC(C)(C)C)C)C	0.05	0.0
Compound_154	CCN(S(=O)(=O)c1cnc(n1C)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.44	0.0
Compound_155	C[C@H]1CCCCN1C(=O)c1nc(sc1c1cnc(cc1C)C(C(F)(F)F)(C(F)(F)F)O)C(=O)NCC(O)(C)C	0.09	0.0
Compound_156	Fc1ccc(cc1)S(=O)(=O)[C@@]1(CC[C@@H](CC1)N1CCOCC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1c(F)cccc1F	0.18	0.0
Compound_157	CCN(C(=O)c1nc(sc1c1ccc(c(c1Cl)Cl)C(C(F)(F)F)(C(F)(F)F)O)C(=O)N1CC(C1)(O)C(O)(C)C)CC	0.11	0.0
Compound_158	OCCOc1nn(cc1S(=O)(=O)N1C[C@H](CNC(=O)C(O)(C)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC	0.01	0.0
Compound_159	F[C@@H]1CN(CC[C@@H]1n1cnnc1)c1cc(F)c(cc1F)CN1[C@@H](C)CC[C@@H](S1(=O)=O)c1ccccc1	0.67	1.0
Compound_160	Clc1ccc(cc1C(=O)Nc1ccccc1F)N(=O)=O	0.97	1.0
Compound_161	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1sc(c(c1)c1cccc(c1)Cl)C(=O)c1cccc(c1)Cl	0.79	1.0
Compound_162	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)NC1CCOCC1	0.02	0.0
Compound_163	N#C[C@@H](c1coc(n1)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)C	0.36	0.0
Compound_164	CCN(C(=O)Cn1cncn1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.1	0.0
Compound_165	OC(=O)C1CCC(CC1)C(=O)N1CC[C@@]2([C@H]1CN(C)c1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.09	0.0
Compound_166	NC(=O)c1ccc(c(c1)c1cnc(c(c1)OCC1CCC1)N(C(=O)c1c(F)cccc1Cl)C)Cl	0.03	0.0
Compound_167	CN([C@@H]1CCN(C1)C(=O)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F)C	0.02	0.0
Compound_168	CC(=O)N[C@@H]1C[C@@H](C1)NC(=O)C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.14	0.0
Compound_169	C[C@@H]1Oc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)C(c1ccc(cc1)F)C	0.29	0.0
Compound_170	CCS(=O)(=O)c1ccc(nc1)C(C(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(=O)C	0.12	0.0
Compound_171	N#Cc1ccc(cc1Cl)NC(=O)CC(CC(=O)Nc1ccc2c(c1)c(=O)n(c(=O)n2CC)CC)C	0.02	0.0
Compound_172	CC(CN(S(=O)(=O)Cc1ccccc1)Cc1ccc(cc1)N1CCN(CC1)C(=O)C1CC1)C	0.24	0.0
Compound_173	O=C(OC(C)(C)C)Nc1cccc(c1)COC(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)C1(CCCC1)S(=O)(=O)c1ccc(cc1)F	0.86	1.0
Compound_174	OC(=O)CC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)S(F)(F)(F)(F)F)NC(=O)OC(C(F)(F)F)(C)C	0.17	0.0
Compound_175	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1(N)CCCC1)S(=O)(=O)c1ccc(cc1)F	0.04	0.0
Compound_176	COc1cc(CCC(F)(F)F)ccc1c1n(CC)nc(c1Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.07	0.0
Compound_177	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1occ(n1)CNS(=O)(=O)C)F	0.31	0.0
Compound_178	O=C(OC(C)(C)C)NC1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)c1c(Cl)cccc1Cl	0.28	0.0
Compound_179	COc1cc(ccc1F)S(=O)(=O)N1C[C@H](CCC(=O)O)Oc2c1cc(cc2)NC(=O)O[C@@H](C(F)(F)F)C(C)(C)C	0.18	0.0
Compound_180	CNC(=O)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OCC(C)(C)C	0.07	0.0
Compound_181	O=C(c1ccc(c(c1C)Cc1cc2c(n1C)cc(cc2C)C(F)(F)F)C)N1CCOCC1	0.15	0.0
Compound_182	O=C(C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)N[C@H]1CC[C@@H](C1)C(=O)O	0.08	0.0
Compound_183	O=C(C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)N[C@@H]1C[C@H](C1)C(=O)O	0.12	0.0
Compound_184	O[C@@H]1C[C@H](C1)NC(=O)c1nc(c(s1)c1c[nH]c(=NC2(C)CCC2)cc1C(F)F)C(=O)N1C2CCC1CC2	0.01	0.0
Compound_185	OCCOc1nn2c(c1S(=O)(=O)N1C[C@H](CNC(=O)C)Oc3c1cc(cc3)NC(=O)OC(C(F)(F)F)(C)C)cccc2	0.02	0.0
Compound_186	CC(=O)Nc1cc(C)c2c(c1)n(C)c(c2)Cc1c(Cl)ccc(c1Cl)C(=O)N1CCOCC1	0.1	0.0
Compound_187	Cc1nccc(c1)C(c1cncn1C)(c1ccc2c(c1)c(Cl)c(c(n2)Cl)c1ccccc1)O	0.79	1.0
Compound_188	OC(=O)C1CC(C1)NC(=O)c1nc(c(s1)c1cc(cc(c1)C(C(F)(F)F)(C(F)(F)F)O)C(C)(C)C)CC1CCCCC1	0.04	0.0
Compound_189	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cc(cnc1Cl)C(F)(F)F)NC(=O)OC(C)(C)C	0.14	0.0
Compound_190	OCC1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(ccc(c1Cl)F)C1CC1	0.03	0.0
Compound_191	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(c1ccccc1)(C)C)C(F)(F)F	0.23	0.0
Compound_192	CC(=O)N1CCN(CC1)c1ccc(c(c1)F)CN(S(=O)(=O)c1cccc(c1Cl)Cl)C1CCC1	0.4	0.0
Compound_193	O=C(N1CCC(C1)(C)O)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.03	0.0
Compound_194	N#CCC[C@]1(C)COc2c(C1)cc(c(c2)N1CCOCC1)NC(=O)c1cnn2c1nccc2	0.01	0.0
Compound_195	OC1CN(C1)c1ccc(cn1)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.09	0.0
Compound_196	CCc1ccc(cc1)N(S(=O)(=O)c1ccc(c(c1)S(=O)(=N)C)NC[C@@H]1[C@@H]2[C@H]1COC2)CC(C)C	0.05	0.0
Compound_197	CCC1N(C[C@@H]2CC[C@H](CC2)C(F)(F)F)Cc2c1ccc(c2)C(=O)N[C@H](c1ccc(cc1)S(=O)(=O)CC)COC(=O)N	0.02	0.0
Compound_198	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1ccn(n1)CCNS(=O)(=O)C)F	0.23	0.0
Compound_199	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1cnc2c(c1)[C@@H](C)N(C2C(C)C)Cc1ccc(cc1)C(F)(F)F	0.13	0.0
Compound_200	O=COC(Cc1nnc(o1)c1nc(c(s1)c1ccc(cc1OC(F)(F)F)S(=O)(=O)N[C@H](C(F)(F)F)CC)CC1CCC1)(C)C	0.43	0.0
Compound_201	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CC(C[C@@H]1C)(F)F)C(=O)N[C@@H](CO)C	0.02	0.0
Compound_202	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C(F)(F)F)C)cc1C(F)F)C(=O)N[C@H](C(O)(C)C)C	0.03	0.0
Compound_203	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@H]1CC[C@@H](CN1)S(=O)(=O)C	0.07	0.0
Compound_204	FC(CN(C(=O)c1ccc(=O)[nH]n1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)F	0.01	0.0
Compound_205	N#Cc1ccc(cc1)[C@@H](N1Cc2c([C@@H]1C(C)C)[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)C)s2)C	0.1	0.0
Compound_206	C[C@@H]1Oc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)C(c1ccccc1C)C	0.12	0.0
Compound_207	CCCn1nc(c(c1c1ccc(cc1OC)C[C@@H](C(F)(F)F)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.12	0.0
Compound_208	CCN(C(=O)c1ccc(cc1)S(=O)(=O)NC)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.22	0.0
Compound_209	Fc1ccc(cc1)S(=O)(=O)[C@]1(CC[C@H](C1)NC(=O)N1CCOCC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F	0.13	0.0
Compound_210	O=C(NS(=O)(=O)c1ccccn1)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C	0.05	0.0
Compound_211	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cnc2n1cccc2)NC(=O)OC(C)(C)C	0.08	0.0
Compound_212	CCN(C(=O)C1CC[C@](C1)(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)CC	0.74	1.0
Compound_213	Oc1n(cc2c1cc(N1CCN(CC1)CC(F)(F)C)c(c2)NC(=O)c1cnn2c1nccc2)C[C@H](C(O)(C)C)F	0.04	0.0
Compound_214	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C(C)C)S(=O)(=O)c1ccc(cc1)F	0.17	0.0
Compound_215	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CNC(=O)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)OC(C)C	0.05	0.0
Compound_216	OC[C@@H](c1ccc(cc1)S(=O)(=O)C)NC(=O)c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C(F)F	0.01	0.0
Compound_217	CC(=O)C(NC1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)c1c(Cl)cccc1Cl)O	0.12	0.0
Compound_218	CCOc1nn(cc1S(=O)(=O)N1C[C@H](CNC(=O)C(O)(C)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC(F)F	0.02	0.0
Compound_219	CCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.43	0.0
Compound_220	OC[C@@H](c1ccc(cn1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)cc(n2CC)C[C@@H]1CC[C@H](CC1)C(F)(F)F	0.03	0.0
Compound_221	COc1cc(=NCCSC(F)(F)F)[nH]cc1c1n(CC)nc(c1C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.03	0.0
Compound_222	CCC(=O)NCC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OCC(C)(C)C	0.14	0.0
Compound_223	FC(COc1cc2c(cc1NC(=O)c1cnn3c1nccc3)cn(c2O)C[C@H](C(O)(C)C)F)F	0.03	0.0
Compound_224	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC2CCCC2)cc1C(F)F)C(=O)NCC1(O)COC1	0.01	0.0
Compound_225	CC(NS(=O)(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C)C	0.21	0.0
Compound_226	O=C1N(c2ccc(cc2)C(=O)O)c2c(/C/1=C/c1c(Cl)cccc1Cl)c(Cl)ccc2	0.47	0.0
Compound_227	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)OC1(CCOCC1)c1ccc(cc1Cl)Cl	0.84	1.0
Compound_228	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)C1CC1)S(=O)(=O)c1cn(nc1C)C(F)F	0.03	0.0
Compound_229	OC(=O)CC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C(F)(F)F)(C)C	0.1	0.0
Compound_230	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CNC(=O)C)Oc2c1cc(cc2)NC(=O)OC(C)(C)C)C	0.13	0.0
Compound_231	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N([C@@H]([C@@H](O2)CNS(=O)(=O)C)C)S(=O)(=O)c1cn(nc1C)C(F)F	0.11	0.0
Compound_232	OC[C@H](Cn1nc(cc1C)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.09	0.0
Compound_233	Fc1ccc(cc1)S(=O)(=O)[C@@]1(CC[C@@H](CC1)NC(=O)c1cccnc1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O	0.11	0.0
Compound_234	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1[nH]c(c(s1)C(=O)c1ccccc1Cl)c1cccc(c1)Cl	0.23	0.0
Compound_235	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(c1ccc([nH]1)O)O	0.1	0.0
Compound_236	N#Cc1ccc(cc1Cl)NC(=O)CC(CC(=O)Nc1ccc2c(c1)c(=O)n(c(=O)n2CC1CC1)CC1CC1)C	0.01	0.0
Compound_237	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1(C)CC1)S(=O)(=O)c1ccc(cc1)F	0.14	0.0
Compound_238	O=C(NC(c1ccc(cc1C)C)c1ccccc1)Cc1ccc2c(c1)cc(o2)C(c1c(C)noc1C)O	0.03	0.0
Compound_239	FC(Oc1cc(F)cc(c1)c1ccc2c(c1)N(C[C@@H](O2)CC1(CCOCC1)C(=O)O)S(=O)(=O)c1cccc(c1)C(F)(F)F)F	0.48	0.0
Compound_240	COc1nc2ccc(cc2c(c1CC(C)C)Cl)[C@](c1cnc(n1C)C)(c1cnnn1C)O	0.71	1.0
Compound_241	CCn1nc(c(c1c1ccc(cc1OC(F)F)[C@@H](C1(CC1)C(F)(F)F)O)Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.03	0.0
Compound_242	OC1CC(C1)C(=O)N=c1cc(n([nH]1)C(C)C)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.02	0.0
Compound_243	CCn1nc(c(c1c1cnc(cc1OC(F)F)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)C	0.22	0.0
Compound_244	O=C(N1CCC2(C1)CCN2C)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.03	0.0
Compound_245	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)C1(F)CCS(=O)(=O)CC1	0.17	0.0
Compound_246	N#Cc1cc(ccc1F)C(=O)Nc1cnc2c(c1C)c(cn2C)[C@@H]1CCN(C(C1)(C)C)C(=O)C1CCCC1	0.1	0.0
Compound_247	FC(CN(C(=O)c1ccc(=O)[nH]c1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)F	0.01	0.0
Compound_248	OC[C@H](COC(c1cc(F)c(cc1F)CN1[C@@H](C)CC[C@@H](S1(=O)=O)c1ccccc1)(C)C)O	0.21	0.0
Compound_249	CCn1nc(c(c1c1ccc(cc1OC(F)F)C[C@@H](C(F)(F)F)C)C)C(=O)NC[C@]1(O)CC[C@H](C[C@H]1O)S(=O)(=O)C	0.04	0.0
Compound_250	CCC(OC(=O)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C)S(=O)(=O)c1cn(nc1C)C(F)F)C	0.05	0.0
Compound_251	CC(Cc1noc(c1)c1onc(c1C1CC1)C(CC(=O)Nc1ccc(cc1Cl)C)CCC(=O)O)C	0.02	0.0
Compound_252	O=C(c1nc(c(s1)c1ccc(c2c1cccc2)S(=O)(=O)NC(C)(C)C)CC1CCCCC1)NC1CS(=O)(=O)C1	0.06	0.0
Compound_253	O[C@@H]1CCC[C@H]1NC(=O)c1nc(c(s1)c1c[nH]c(=N[C@H](C(F)(F)F)C)cc1C(F)F)C(=O)N1CC(C[C@@H]1C)(F)F	0.01	0.0
Compound_254	OC[C@@H](c1ccc(cn1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)cc(n2CC)C(=O)c1ccc(cn1)C(F)(F)F	0.01	0.0
Compound_255	N#Cc1cccc(c1)c1[nH]c(=NC(=O)Cc2ccc(cc2)S(=O)(=O)CC)sc1Oc1ccccc1C(F)(F)F	0.19	0.0
Compound_256	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1C2CCC1CC2)C(=O)N[C@H]1CC[C@@H](C1)O	0.01	0.0
Compound_257	OCCC1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C	0.08	0.0
Compound_258	O=C(N1CC2(C1)CCO2)C1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.02	0.0
Compound_259	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)CCN1CCCc2c1cc(cc2)CC(C)(C)C	0.1	0.0
Compound_260	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1occ(n1)[C@@H](N)C)F	0.47	0.0
Compound_261	OCCOc1nn(cc1S(=O)(=O)N1C[C@H](CNC(=O)C(O)(C)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C(C)C	0.01	0.0
Compound_262	OC(=O)c1ccc(c(c1)F)c1nn(c2c1CCOC2)C(=O)c1c(Cl)cccc1C1CC1	0.03	0.0
Compound_263	CCn1nc(c(c1c1c[nH]c(=NC(CC(F)(F)F)(C)C)cc1OC(F)F)Cl)C(=O)NC[C@H]1CC[C@@H](C[C@@H]1O)S(=O)(=O)C	0.02	0.0
Compound_264	C[C@H](Cn1ncc(c1)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.15	0.0
Compound_265	OCC(c1cc(F)c(cc1F)CN1[C@@H](C)CC[C@@H](S1(=O)=O)c1ccccc1)c1ccccc1	0.41	0.0
Compound_266	O=C(C1CC1)N=c1cc(n([nH]1)C(C)C)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.07	0.0
Compound_267	Fc1ccc(cc1)S(=O)(=O)N1CC(CC(=O)N=c2scn[nH]2)Sc2c1ccc(c2)C(C(F)(F)F)(C(F)(F)F)O	0.42	0.0
Compound_268	CC(N(C(=O)c1nc(sc1c1ccc(c(c1Cl)Cl)S(=O)(=O)N[C@H](C(F)(F)F)C)C(=O)NCC(O)(C)C)C(C)C)C	0.17	0.0
Compound_269	F[C@@H](C(O)(C)C)Cn1cc2c(c1O)cc(c(c2)NC(=O)c1cnn2c1nccc2)OC1CC1	0.05	0.0
Compound_270	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1cc[nH]c(=NS(=O)(=O)C)n1)F	0.22	0.0
Compound_271	Fc1ccc(cc1)S(=O)(=O)C1(CCCC1)c1ccc(cc1)C(c1ccccc1)(F)F	0.98	1.0
Compound_272	Fc1ccc(cc1)S(=O)(=O)C1(CCCC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1ccc2c(c1)cccc2	0.96	1.0
Compound_273	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CC(C[C@@H]1C)(F)F)C(=O)NC1CCS(=O)(=O)CC1	0.04	0.0
Compound_274	CCOc1sc(nc1S(=O)(=O)N1C[C@H](CC(C(=O)O)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC	0.07	0.0
Compound_275	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1sc2c([nH]1)[C@@H](N(C2)Cc1ccc(cc1)F)C(C)C	0.05	0.0
Compound_276	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(CC(O2)c1n[nH]c(=O)o1)S(=O)(=O)c1cn(nc1C)C(F)F	0.08	0.0
Compound_277	Fc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c(cn2C)C1CCN(CC1)C(=O)C1CC1	0.29	0.0
Compound_278	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)c1c(C)noc1C)S(=O)(=O)c1ccc(c(c1)Cl)F	0.05	0.0
Compound_279	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C1CC(C1)(F)F)S(=O)(=O)c1ccc(c(c1)Cl)F	0.41	0.0
Compound_280	O=C(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C)NCc1cnn(c1)C	0.04	0.0
Compound_281	Fc1ccc(cc1)S(=O)(=O)[C@]12CC[C@H]([C@@H]2CCc2c1ccc(c2)C(C(F)(F)F)(C(F)(F)F)F)n1c(=O)[nH]c(c1O)CC(O)(C)C	0.05	0.0
Compound_282	C[C@@H]([C@H](NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N1CCC[C@@H]1C)C)O	0.03	0.0
Compound_283	C[C@H]1CCCCN1C(=O)c1nc(sc1c1c[nH]c(=N[C@H]2CCCCC2(F)F)cc1C(F)(F)F)C(=O)NCC(O)(C)C	0.02	0.0
Compound_284	O[C@@H]1C[C@H](O)CN(C1)C(=O)c1nc(c(s1)c1ccc(cc1OC(F)(F)F)C(C(F)(F)F)(C(F)(F)F)O)C(=O)N1CC(C[C@@H]1C)(F)F	0.05	0.0
Compound_285	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)CCN1CCOc2c1cc(cc2)OC(C)C	0.38	0.0
Compound_286	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@H]1CC[C@H](C[C@H]1O)S(=O)(=O)C	0.05	0.0
Compound_287	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(C(F)(F)F)(F)F)C1CCCCC1	0.21	0.0
Compound_288	COc1cc(=NCCCC(F)(F)F)[nH]cc1c1n(CC)nc(c1Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.04	0.0
Compound_289	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N[C@H]1COCC1	0.02	0.0
Compound_290	N#Cc1ccc(nc1)CN1Cc2c([C@]1(C)C(C)C)[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)CC)s2	0.06	0.0
Compound_291	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1sc2c([nH]1)[C@@H](N(C2)[C@@H](c1cc(Br)ccc1F)C)C(C)C	0.09	0.0
Compound_292	FC(Oc1cc(ccc1c1n(nc(c1C)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C)CC(O)(C)C)CC(C(F)(F)F)(C)C)F	0.05	0.0
Compound_293	Fc1ccc(cc1)S(=O)(=O)[C@@]12CCN([C@@H]1CCc1c2ccc(c1)OCc1c(F)cccc1C(F)(F)F)C(=O)C1CCN(CC1)C(=O)N	0.13	0.0
Compound_294	Fc1ccc(cc1)S(=O)(=O)C1(CCCC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1cc(Cl)ccc1F	0.97	1.0
Compound_295	C[C@H]1OC[C@@H](S(=O)(=O)N(C1)Cc1ccc(cc1F)N1CCN(CC1)C(=O)C)c1ccccc1	0.04	0.0
Compound_296	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=N[C@H](C(F)(F)F)C2CC2)cc1C(F)F)C(=O)N[C@H](C(O)(C)C)C	0.02	0.0
Compound_297	CC(=O)N1CC2CC(C1)N2c1ccc2c(c1)CCN(C2)S(=O)(=O)N(Cc1c(F)cccc1Cl)C	0.19	0.0
Compound_298	COc1cc(ccc1F)S(=O)(=O)N1C[C@H](CNC(=O)C)Oc2c1cc(cc2)NC(=O)OCC1(CC1)C(F)(F)F	0.18	0.0
Compound_299	N#CCCC(=O)N1Cc2c(C1C(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)ccc(c2)S(=O)(=O)CC	0.06	0.0
Compound_300	COc1nc2ccc(cc2c(c1CN1CCC(CC1)(O)C(F)(F)F)Cl)[C@](c1cncn1C)(c1ccnc(c1)C(F)(F)F)O	0.01	0.0
Compound_301	Fc1cccc(c1COc1ccc2c(c1)N(CC2)S(=O)(=O)c1cccc(c1)C(F)(F)F)Cl	0.67	1.0
Compound_302	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(c(c1)Cl)c1ccccc1	0.63	1.0
Compound_303	CCn1nc(c(c1)S(=O)(=O)N1[C@@H](C)[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC(C(=O)O)(C)C)Cl	0.11	0.0
Compound_304	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CNC(=O)C(O)(C)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)OCC(F)F	0.02	0.0
Compound_305	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1sc2c([nH]1)[C@@H](N(C2)CC1CCC(CC1)C(F)F)C(C)C	0.09	0.0
Compound_306	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)NC(=O)N	0.24	0.0
Compound_307	Clc1ccc(c(c1)S(=O)(=O)N(C1CCC1)Cc1ccc(cc1F)N1CCN(CC1)C(=O)C)Cl	0.43	0.0
Compound_308	N#Cc1cccc(c1)C(=O)Nc1cnc2c(c1C)c(cn2C)[C@@H]1CCN(C[C@@H]1C)C(=O)C1CCCC1	0.03	0.0
Compound_309	CC(CNC(=O)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C)C	0.05	0.0
Compound_310	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1[nH]c2c(s1)CN([C@H]2C(C)C)Cc1ccc(cn1)OC(F)F	0.01	0.0
Compound_311	OCC1CCc2c(C1)n(nc2c1ccc(cc1F)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.04	0.0
Compound_312	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc2c(c1)ccn2CCc1ccc(cc1)OC(C)C	0.27	0.0
Compound_313	Fc1ccc(cc1)S(=O)(=O)N1C(C)COc2c1cc(cn2)NC(=O)c1c(Cl)cccc1C(F)(F)F	0.22	0.0
Compound_314	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)N1CC(C1)(C)O	0.19	0.0
Compound_315	OC(=O)C1CCN(C(=O)C1)c1nn(c2c1c(F)ccc2)C(=O)c1c(Cl)cccc1C(F)(F)F	0.01	0.0
Compound_316	C[C@H]1CC[C@@H](S(=O)(=O)C1Cc1ccc(cc1F)N1CCC2(CC1)N(C)C(=O)N(C2=O)C)c1ccccc1	0.04	0.0
Compound_317	O=C(C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)NCC(O)(C)C	0.05	0.0
Compound_318	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cccc(n1)n1cnc(n1)CC1CS(=O)(=O)C1)F	0.31	0.0
Compound_319	CCS(=O)(=O)c1ccc(cc1)CNC(c1sc2c(n1)c(n(c2)Cc1ccc(cc1)Cl)C(C)C)O	0.3	0.0
Compound_320	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](Oc2c1cc(cc2)N(C(C(F)(F)F)(C)C)C(=O)O)CC(C(=O)N)(C)C)Cl	0.08	0.0
Compound_321	N#Cc1cccc(c1)S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)O[C@H]1CC2CC1CC2)Cn1c(O)coc1=O	0.04	0.0
Compound_322	Fc1cc(ccc1c1nn(c2c1nccc2)C(=O)c1c(Cl)c(F)ccc1C1(CC1)C(F)(F)F)C(=O)O	0.47	0.0
Compound_323	OC(=O)CCNC(=O)C1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(c(c1)Cl)F)NC(=O)OC(C)(C)C	0.04	0.0
Compound_324	FC1CC(C1)C(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C	0.22	0.0
Compound_325	COc1nc2ccc(cc2c(c1OC(C1CC1)C)Cl)C(c1cnc(n1C)C)(c1cnc(n1C)C)O	0.36	0.0
Compound_326	CCCN(Cc1ccc(cc1)OC1CCCC1)Cc1ccc(cc1)NC(=O)Cc1ccc(cc1)S(=O)(=O)CC	0.18	0.0
Compound_327	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1cncc(n1)c1cnc(nc1)CS(=O)(=O)C)F	0.49	0.0
Compound_328	OCC1CCC(C1)(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1c(F)cccc1F)S(=O)(=O)c1ccc(cc1)F	0.84	1.0
Compound_329	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1ccnc(n1)n1ccc(n1)C(F)F)F	0.52	1.0
Compound_330	N#Cc1cc(ccc1CC1CCN(CC1)C(=O)C(C)(C)C)c1ccc(cc1C(F)(F)F)NC(=O)Cc1ccc(cc1)S(=O)(=O)CC	0.13	0.0
Compound_331	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N[C@@H]1C[C@@H]1O	0.01	0.0
Compound_332	OC(=O)C1CC(C1)NC(=O)c1nc(c(s1)c1ccc(c(c1Cl)Cl)S(=O)(=O)NC(C)(C)C)CC1CCCCC1	0.09	0.0
Compound_333	CC(CC1CC(C1)c1nnc(n1C1CC1)C1C[C@@H](CC1C(=O)Nc1ccc(cc1C)C)O)C	0.05	0.0
Compound_334	CCC(N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)NCC(O)(C)C)(C)C	0.01	0.0
Compound_335	O[C@@H]1CC[C@H]1NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C)(C)C)cc1C(F)F)C(=O)N1CCC[C@@H]1C	0.01	0.0
Compound_336	CC(=O)N=c1cc(n([nH]1)CC(C)(C)C)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.09	0.0
Compound_337	O=C(C1CC(C1)(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)NCC1CCOCC1	0.19	0.0
Compound_338	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(C(F)(F)F)(C)C)Cl)C(=O)NC[C@@]1(O)CC[C@H](C[C@@H]1O)S(=O)(=O)C	0.03	0.0
Compound_339	CCN(S(=O)(=O)c1ccc(c(c1)F)F)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.61	1.0
Compound_340	N#Cc1cc(ccc1OC)C(=O)Nc1cnc2c(c1C)c(cn2C)C1CCN(CC1)C(=O)C(C(C)(C)C)C	0.1	0.0
Compound_341	CCN(C(=O)CN1CC(C1)O)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.21	0.0
Compound_342	COc1nn(c(c1S(=O)(=O)N1C[C@H](CCC(=O)O)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C)C	0.04	0.0
Compound_343	CN(CCNC(=O)C1CCc2c(C1)n(nc2c1ccc(cc1F)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F)C	0.01	0.0
Compound_344	CC(=O)N=c1cc(n([nH]1)C(C)C)c1ccc(c(c1)N1CCCC1)N(C([2H])([2H])[2H])C(=O)c1c(F)cccc1Cl	0.04	0.0
Compound_345	OCC(c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1ccc(cc1)CCN1CCCc2c1cc(cc2)CC(C)C	0.03	0.0
Compound_346	CCn1nc(c(c1c1ccc(cc1OC(F)F)C[C@H](C(F)(F)F)C)Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.06	0.0
Compound_347	N#Cc1cc(C)c2c(c1)n(C)c(c2)Cc1c(Cl)ccc(c1Cl)C(=O)N1CCC(C1)O	0.09	0.0
Compound_348	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(C(=O)C(F)(F)F)O	0.41	0.0
Compound_349	COc1nn2c(c1S(=O)(=O)N1C[C@@H](Oc3c1cc(cc3)NC(=O)OC(C(F)(F)F)(C)C)CC(C(=O)O)(C)C)CCC2	0.07	0.0
Compound_350	Fc1ccc(cc1)S(=O)(=O)[C@@]12CC[C@H]([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)NC(=O)c1ccc(=O)[nH]c1	0.06	0.0
Compound_351	FC1CCN(CC1)C(=O)c1nc(sc1c1c[nH]c(=N[C@@H](C2CC2)C)cc1C(F)(F)F)C(=O)NCC(O)(C)C	0.01	0.0
Compound_352	COc1cc(=NC(CC(F)(F)F)(C)C)[nH]cc1c1n(CC)nc(c1Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.05	0.0
Compound_353	OC(=O)C[C@@H]1CCN(C[C@@H]1C)C(=O)c1ccc(c(c1Cl)C(=O)c1cc2c(n1C)nc(cc2C)C(F)(F)F)Cl	0.02	0.0
Compound_354	CC(=O)N[C@H]([C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cn(nc1C)C(F)F)NC(=O)OC(C(F)(F)F)(C)C)C	0.19	0.0
Compound_355	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)CCN1CCCc2c1cc(cc2)C(C)C	0.1	0.0
Compound_356	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)Cn1cncn1)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.25	0.0
Compound_357	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N	0.02	0.0
Compound_358	COCCC1CCN(CC1)C(=O)c1ccc(c(c1Cl)Cc1cc2c(n1C)cc(cc2C)C#N)Cl	0.31	0.0
Compound_359	COCCc1cn(nc1CCS(=O)(=O)C)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.52	1.0
Compound_360	CCN(C(=O)c1ccc2c(c1)nc([nH]2)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.08	0.0
Compound_361	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)N1CCOCC1)S(=O)(=O)c1ccc(cc1)F	0.12	0.0
Compound_362	OC(=O)c1ccc(c(c1)F)c1nn(c2c1nccc2)C(=O)c1c(C)cccc1N(C)C	0.26	0.0
Compound_363	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1ccnc(n1)c1cc[nH]c(=NS(=O)(=O)C)c1)F	0.21	0.0
Compound_364	O=C(c1ccc(c(c1Cl)C(=O)c1cc2c(n1C)cc(cc2C)C(F)(F)F)Cl)N1CCN(CC1)C1COC1	0.03	0.0
Compound_365	CC(Cc1nnc(s1)c1onc(c1C1CC1)C(CC(=O)Nc1ccc(cc1Cl)C)CCC(=O)O)C	0.06	0.0
Compound_366	Clc1ccc(c(c1Cc1nc2n(c1C)nc(cc2C)C(F)(F)F)Cl)C(=O)N1CCC(CC1)C1COC1	0.06	0.0
Compound_367	CCN(C1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C)NC(=O)c1c(Cl)cccc1Cl)CC	0.19	0.0
Compound_368	N#Cc1cccc(c1)C(=O)Nc1cnc2c(c1C(F)(F)F)c(cn2C)[C@@H]1CCN(C(C1)(C)C)C(=O)C1CCCC1	0.05	0.0
Compound_369	CCc1ccc(cc1)CN1Cc2c([C@@H]1C(C)C)[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)CC)s2	0.06	0.0
Compound_370	OCC(Cc1nnc(o1)C[C@@H]1CCc2c(N1S(=O)(=O)c1ccc(cc1)F)ccc(c2)C(C(F)(F)F)(C(F)(F)F)O)O	0.05	0.0
Compound_371	OC[C@@H](c1ccc(cn1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C1CCC1	0.03	0.0
Compound_372	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N[C@@H]([C@@H](O)C)C	0.03	0.0
Compound_373	N#Cc1cccc(c1)C(=O)Nc1cnc2c(c1C)c(cn2C)C1CCN(CC1)C(=O)C(C12CC(C1)C2)C	0.03	0.0
Compound_374	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2Cc1cccc(c1O)O)C1CC1	0.03	0.0
Compound_375	O=C(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C)NOCc1ccccc1	0.08	0.0
Compound_376	FC(Oc1cc(F)cc(c1)c1ccc2c(c1)N(CC2)S(=O)(=O)c1cccc(c1)C(F)(F)F)F	0.83	1.0
Compound_377	O=C1NC(=O)C2(N1)CCN(CC2)C(=O)C1CC(C1)(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.07	0.0
Compound_378	OC[C@@]1(CC[C@@H](CC1)S(=O)(=O)C)CNC(=O)c1nn(c(c1Cl)c1ccc(cc1OC)CC(C(F)(F)F)C)CC	0.05	0.0
Compound_379	Clc1cccc(c1)S(=O)(=O)N(C1CCC1)Cc1ccc(cc1F)N1CCN(CC1)C(=O)C	0.43	0.0
Compound_380	CC1CCN(C1)S(=O)(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(c(c1)Cl)F)NC(=O)OC(C(F)(F)F)(C)C	0.21	0.0
Compound_381	O=COC(Cc1onc(n1)c1sc(c(n1)CC1CCCCC1)c1cc(cc(c1)C1(C)CC1)C(=O)N[C@H](C(F)(F)F)C)(C)C	0.06	0.0
Compound_382	N#CCCc1ncn(n1)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.22	0.0
Compound_383	CC(=O)N1CCN(CC1)c1ccc(c(c1)F)CN1CCCCN(S1(=O)=O)c1ccccc1	0.1	0.0
Compound_384	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CC1(CC1)C(=O)O)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.11	0.0
Compound_385	CCn1nc(c(c1c1ccc(cc1OC(F)F)C[C@@H](C(F)(F)F)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.14	0.0
Compound_386	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CNC(=O)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)OCC(F)F	0.03	0.0
Compound_387	OCCNC(=O)c1ccc2c(c1)n(nc2c1ccc(cc1)C(=O)O)C(=O)c1c(Cl)cccc1C(F)(F)F	0.07	0.0
Compound_388	CCOC(=O)NC1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)c1c(Cl)cccc1Cl	0.17	0.0
Compound_389	OCCN(C(=O)c1noc(c1)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.1	0.0
Compound_390	OC[C@@H](c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1cnc2c(c1)CN(C2CC)C[C@H]1CC[C@@H](OC1)C(F)(F)F	0.01	0.0
Compound_391	O[C@H]1COC[C@H]1NC(=O)c1nc(c(s1)c1c[nH]c(=NC2(C)CCC2)cc1C(F)(F)F)C(=O)N1CC(C[C@@H]1C)(F)F	0.01	0.0
Compound_392	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@H](O2)CCN1CCCC1=O)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.16	0.0
Compound_393	CCN(C(=O)c1cnccn1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.03	0.0
Compound_394	CO[C@H]1C[C@H]2N(C1)CCN(C2)c1cc2c(cc1NC(=O)c1cnn3c1nccc3)cn(c2O)C[C@H](C(O)(C)C)F	0.03	0.0
Compound_395	OC(=O)CCC1CN(c2c1ccc(c2)c1cc(F)cc(c1)OC(F)F)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.44	0.0
Compound_396	CCn1nc(c(c1)S(=O)(=O)N1C[C@H](CCc2n[nH]c(=O)o2)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)Cl	0.09	0.0
Compound_397	CC(Oc1c(nc2c(c1Cl)cc(cc2)[C@@](c1cnc(n1C)C)(c1cnnn1C)O)N1CCC1)C	0.12	0.0
Compound_398	Fc1cccc(c1c1nnc2c(c1)[C@@H]1CC[C@]2(C1(C)C)c1ccnc(n1)c1cncn1CCS(=O)(=O)C)F	0.17	0.0
Compound_399	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1C2CCC1CC2)C(=O)N[C@@H]1COC[C@H]1O	0.0	0.0
Compound_400	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)OC(c1ccc(cc1Cl)Cl)(C)C	0.79	1.0
Compound_401	OC(=O)CC1CCN(CC1)C(=O)c1ccc(c(c1Cl)Cc1cc2c(n1C)cc(cc2)OC(F)(F)F)Cl	0.07	0.0
Compound_402	CC(NC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C)C	0.29	0.0
Compound_403	OCCc1ncn(n1)c1nccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.03	0.0
Compound_404	N#Cc1cc(=NC2CCCCC2)[nH]cc1c1sc(nc1C(=O)N1CCC(CC1)F)C(=O)NCC(O)(C)C	0.01	0.0
Compound_405	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CCN1CCCC1=O)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.16	0.0
Compound_406	O=C1/C(=C\c2c(Cl)cccc2Br)/c2c(N1c1ccc(c(c1)O)C(=O)O)cccc2C	0.32	0.0
Compound_407	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2C1CC1)C(=O)c1ccc(cc1)C(F)(F)F	0.05	0.0
Compound_408	N#Cc1ccc(cc1)[C@H](N1Cc2c([C@@H]1C(C)C)[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)C)s2)C	0.1	0.0
Compound_409	OCC(c1nnc(o1)C[C@@H]1CCc2c(N1S(=O)(=O)c1ccc(cc1)F)ccc(c2)C(C(F)(F)F)(C(F)(F)F)O)(O)C	0.05	0.0
Compound_410	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)C)S(=O)(=O)c1cn(nc1C)C(F)F	0.1	0.0
Compound_411	N#Cc1cc(C)c2c(c1)n(C)c(c2)Cc1c(Cl)ccc(c1Cl)C(=O)N1CCC2(CC1)COCC2	0.11	0.0
Compound_412	CCn1ncc(c1C)CNC(=O)C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C	0.02	0.0
Compound_413	N#CCCN1C(=O)CCC1C(=O)N[C@@H]1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.06	0.0
Compound_414	CN(CCN1CCN(CC1)c1cc2OC(Cc2cc1NC(=O)c1cnn2c1nccc2)(C)C)C	0.0	0.0
Compound_415	CCn1nc(c(c1)S(=O)(=O)N1CC(Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C(=O)C(F)(F)F)Cl	0.26	0.0
Compound_416	CC(=O)N=c1cc(n([nH]1)C1CCC1)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.04	0.0
Compound_417	NC(=O)CCc1ncn(n1)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.05	0.0
Compound_418	C[C@H]1CC(CN1C(=O)c1nc(sc1c1c[nH]c(=NC(C2CC2)(C)C)cc1C(F)F)C(=O)NCC(O)(C)C)(F)F	0.01	0.0
Compound_419	CCS(=O)(=O)c1ccc(cc1)C(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C	0.2	0.0
Compound_420	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CCNC(=O)C(C)C)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.06	0.0
Compound_421	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CC(C(=O)O)(C)C)S(=O)(=O)c1c(Cl)nn2c1CCCC2	0.09	0.0
Compound_422	Fc1ccc(cc1)S(=O)(=O)[C@@]1(CC[C@@H](CC1)NC(=O)c1ccnnc1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F	0.33	0.0
Compound_423	CC(Oc1cc2c(cc1NC(=O)c1cnn3c1ncc(c3)C)cn(c2O)C[C@H](C(O)(C)C)F)C	0.18	0.0
Compound_424	O=C1/C(=C\c2c(Cl)cccc2C2CC2)/c2c(N1c1ccc(c(c1)O)C(=O)O)cccc2C	0.21	0.0
Compound_425	CCN(C(=O)c1ccc(nn1)CS(=O)(=O)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.14	0.0
Compound_426	Fc1cc(C(=O)O)c(cc1c1nn(c2c1c(F)ccc2)Cc1c(F)cccc1Cl)O	0.1	0.0
Compound_427	OC[C@@H](c1ccc(cc1)S(=O)(=O)CC)NC(=O)c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C1CC1	0.02	0.0
Compound_428	OC(=O)C1CC(C1)NC(=O)c1nc(c(s1)c1cnc(c2c1cccc2)S(=O)(=O)NC(C)(C)C)CC1CCCCC1	0.1	0.0
Compound_429	N#CCc1cc(ccc1OCC1CCOCC1)S(=O)(=O)N(c1ccc(cc1)CC)CC(C)C	0.68	1.0
Compound_430	OC(=O)c1ccc(cc1O)n1cc(c2c1c(F)ccc2)C(=O)c1c(Cl)cccc1C(F)(F)F	0.16	0.0
Compound_431	Clc1cccc(c1C(=O)c1cn(c2c1cccc2)c1ccc(c(c1)O)C(=O)O)Cl	0.4	0.0
Compound_432	C[C@H]1CC(CN1C(=O)c1nc(sc1c1c[nH]c(=N[C@H](C(F)(F)F)C2CC2)cc1C(F)F)C(=O)N[C@@H](C(O)(C)C)C)(F)F	0.02	0.0
Compound_433	CCn1nc(c(c1)S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)[C@@H](NC(=O)C)C)Cl	0.16	0.0
Compound_434	O=C(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C)NCC1CC1	0.03	0.0
Compound_435	N#Cc1ccc(cn1)CN1Cc2c([C@@H]1C(C)C)[nH]c(=NC(=O)Cc1ccc(cc1)S(=O)(=O)CC)s2	0.05	0.0
Compound_436	C[C@H]1CC(CN1C(=O)c1nc(sc1c1c[nH]c(=NC2(C)CCC2)cc1C(F)(F)F)C(=O)N[C@H](C(O)(C)C)C)(F)F	0.02	0.0
Compound_437	OCCOc1nn(cc1S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)[C@H](C1CC1)NC(=O)C(O)(C)C)CC	0.01	0.0
Compound_438	CCn1nc(c(c1c1c(F)cc(cc1F)CC(C(F)(F)F)C)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.24	0.0
Compound_439	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(CC(F)(F)F)(C)C)Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.07	0.0
Compound_440	OC(=O)CC1CCN(CC1)C(=O)c1ncc(c(c1Cl)Cn1cc(c2c1c(C)cc(c2)C(F)(F)F)C)Cl	0.05	0.0
Compound_441	OC[C@H](c1ccc(cn1)S(=O)(=O)CC)NC(=O)c1cnc2c(c1)CN(C2C(C)C)C[C@@H]1CC[C@H](CC1)C(F)(F)F	0.01	0.0
Compound_442	CCn1nc(c(c1c1ccc(cc1OC(F)F)C[C@H](C(F)(F)F)C)C)C(=O)NC[C@]1(O)CC[C@H](C[C@H]1O)S(=O)(=O)C	0.04	0.0
Compound_443	C[C@@H]([C@@H](NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N1CCC[C@@H]1C)C)O	0.03	0.0
Compound_444	N#C[C@@]1(CC[C@@H](CC1)S(=O)(=O)C)CNC(=O)c1nn(c(c1Cl)c1ccc(cc1)CC(C(F)(F)F)(C)C)CC	0.18	0.0
Compound_445	OC(=O)CC[C@@H]1Oc2c(F)cc(cc2N(C1)S(=O)(=O)c1ccnc(c1)C(F)(F)F)NC(=O)OC(C(F)(F)F)(C)C	0.13	0.0
Compound_446	OC(=O)c1ccc(cc1)N1c2cccc(c2/C(=C\c2c(Cl)cccc2C(F)(F)F)/C1=O)F	0.19	0.0
Compound_447	Fc1cc(N2CC3[C@H](C2)[C@H]3n2cnnc2)c(cc1CN1[C@H](CC[C@@H](S1(=O)=O)c1ccccc1)C(F)(F)F)F	0.41	0.0
Compound_448	Fc1ccc(cc1)S(=O)(=O)[C@@]1(CC[C@@H](CC1)N1CCS(=O)(=O)CC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F	0.06	0.0
Compound_449	N#Cc1cccc(c1)N(S(=O)(=O)c1ccc(cc1)OC1CCN(CC1)S(=O)(=O)C)CC(C)C	0.52	1.0
Compound_450	COc1nc2ccc(cc2c(c1C1CCCC1)Cl)[C@@](c1cnnn1C)(c1ccc(nc1C)C)O	0.69	1.0
Compound_451	CC(=O)NC1Cc2ncc(cc2N(C1)S(=O)(=O)c1cccc(c1)C1CC1)NC(=O)c1c(Cl)cccc1Cl	0.29	0.0
Compound_452	COC(=O)C1CCC(=CC1)c1nn(c2c1CCC(C2)C(=O)O)C(=O)c1c(Cl)cccc1C1CC1	0.04	0.0
Compound_453	CCS(=O)(=O)c1ccc(cc1)CC(=O)N=c1sc2c([nH]1)C(N(C2)Cc1ccc(cc1)F)Cc1cccc(c1)Br	0.06	0.0
Compound_454	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2Cc1cccc2c1OC(O2)(F)F)C(C)C	0.07	0.0
Compound_455	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)NC1CN(C1)S(=O)(=O)C	0.03	0.0
Compound_456	COC(=O)COc1nn(cc1S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)[C@H](C1CC1)NC(=O)C)CC	0.04	0.0
Compound_457	CCS(=O)(=O)c1ccc(nc1)[C@H](NC(=O)c1cnc2c(c1)CN(C2C(C)C)C[C@@H]1CC[C@@H](CC1)C(F)(F)F)COC(=O)N	0.02	0.0
Compound_458	CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2[C@@H](O)C=C2[C@]1(C)CC[C@@H](C2)O)C)C	0.11	0.0
Compound_459	O[C@@H]1CCC[C@H]1NC(=O)c1nc(c(s1)c1c[nH]c(=N[C@H](C(F)(F)F)C)cc1C(F)F)C(=O)N1CCC[C@@H]1C	0.01	0.0
Compound_460	OC[C@@H](Cn1ccc(n1)c1cccc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.09	0.0
Compound_461	Fc1cc(CN2CCN([C@H](C2)C)C(=O)C2CCCC2)c(c(c1)NC(=O)c1ccc(nc1)C)C	0.02	0.0
Compound_462	Fc1ccc(cc1)S(=O)(=O)[C@]1(CCN(C1)C(=O)C12CCC(CC1)(CC2)C(=O)O)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)F	0.35	0.0
Compound_463	O[C@@H]1CCC[C@H]1NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N1CCC[C@@H]1C	0.01	0.0
Compound_464	CN1CC(C1)NC(=O)c1nc(c(s1)c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)N1CCC[C@@H]1C	0.01	0.0
Compound_465	OC(=O)C1CCC(=CC1)c1nn(c2c1CCC(C2)C(=O)N1CC2(C1)CCCO2)C(=O)c1c(ccc(c1Cl)F)C1CC1	0.02	0.0
Compound_466	COc1cc(CCCC(F)(F)F)ccc1c1n(CC)nc(c1C)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.1	0.0
Compound_467	CC(=O)C(NCc1coc(n1)c1cncc(n1)[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F)O	0.05	0.0
Compound_468	CCn1nc(c(c1c1c[nH]c(=NC(CC(F)(F)F)(C)C)cc1OC(F)F)Cl)C(=O)NC[C@@]1(O)CC[C@@H](C[C@@H]1O)S(=O)(=O)C	0.02	0.0
Compound_469	CCN(C(=O)C1CN(C1)C(=O)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.05	0.0
Compound_470	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC(C)(C)C)cc1C(F)(F)F)C(=O)NCC(C(F)(F)F)(C(F)(F)F)O	0.01	0.0
Compound_471	COC1CC(C1)C(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C	0.3	0.0
Compound_472	CCN(C(=O)C1CN(C1)S(=O)(=O)C)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.27	0.0
Compound_473	O=C(C[C@@H]1CCc2c(N1S(=O)(=O)c1ccc(cc1)F)ccc(c2)C(C(F)(F)F)(C(F)(F)F)O)NCC(O)(C)C	0.03	0.0
Compound_474	OCC1CCc2c(C1)n(nc2C1=CCC(CC1)C(=O)O)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F	0.06	0.0
Compound_475	CC(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)Cc1ccccc1	0.08	0.0
Compound_476	CCN(C(=O)c1ccc(cc1)c1ncccn1)C[C@@]12CC[C@H](C2(C)C)c2c1nnc(c2)c1c(F)cccc1F	0.06	0.0
Compound_477	CCn1nc(c(c1c1ccc(cc1OC(F)F)CC(C(F)(F)F)C(F)(F)F)Cl)C(=O)NC[C@@H]1CC[C@H](CC1)S(=O)(=O)C	0.12	0.0
Compound_478	C[C@H]1CCCN1C(=O)c1nc(sc1c1c[nH]c(=NC2(CCC2)C(F)(F)F)cc1C(F)F)C(=O)NCC(O)(C)C	0.01	0.0
Compound_479	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)(F)F)c1sc(nc1C(=O)N1CC(C[C@@H]1C)(F)F)C(=O)NCC(O)(C)C	0.01	0.0
Compound_480	N#Cc1c(nn(c1c1ccc(cc1OC)CC(C(F)(F)F)(C)C)CC)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C	0.06	0.0
Compound_481	CCS(=O)(=O)c1ccc(cc1)CC(=O)Nc1ccc(cc1)CCN1CCCc2c1cc(C)cc2	0.06	0.0
Compound_482	N#Cc1cc(C)c2c(c1)n(C)c(c2)Cc1c(Cl)ncc(c1Cl)C(=O)N1CCOCC1	0.07	0.0
Compound_483	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNC(=O)C(O)(C)C)S(=O)(=O)c1ccc(cc1)F	0.04	0.0
Compound_484	N#CCCN1C(=O)CCC1C(=O)N1CC[C@@]2([C@H]1CCc1c2cnc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F	0.06	0.0
Compound_485	Fc1ccc(cc1)S(=O)(=O)C1(CC(C1)C(=O)N1CCOCC1)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)OCc1c(F)cccc1F	0.37	0.0
Compound_486	OC(=O)CC1CCN(CC1)C(=O)c1ccc(c(c1Cl)Cn1ccc2c1ccc(c2)C(C)C)Cl	0.04	0.0
Compound_487	COC(=O)C1CCOCC1c1cc(F)c(cc1F)CN1[C@@H](C)CC[C@@H](S1(=O)=O)c1ccccc1	0.61	1.0
Compound_488	COc1nc2ccc(cc2c(c1CC(C)C)Cl)[C@](c1cnnn1C)(c1ccc(nc1C)C)O	0.87	1.0
Compound_489	N#C[C@@]1(CC[C@@H](CC1)S(=O)(=O)C)CNC(=O)c1nn(c(c1Cl)c1ccc(cc1OC)N[C@@H](C(F)(F)F)C)CC	0.12	0.0
Compound_490	C[C@@H](COc1nn2c(c1S(=O)(=O)N1C[C@H](CNC(=O)C)Oc3c1cc(cc3)NC(=O)OC(C(F)(F)F)(C)C)CCCC2)O	0.02	0.0
Compound_491	CC[C@@H](C(F)(F)F)N=c1[nH]cc(c(c1)C(F)F)c1sc(nc1C(=O)N1CCC[C@@H]1C)C(=O)N[C@@H]1C[C@H](C1)O	0.01	0.0
Compound_492	OC(=O)C(Cc1nc(c(s1)c1ccc(c(c1Cl)Cl)S(=O)(=O)N[C@H](C(F)(F)F)C)CC1CCC1)(C)C	0.31	0.0
Compound_493	O=C(c1nc(c(s1)c1cnc(c2c1cccc2)S(=O)(=O)NC(C)(C)C)CC1CCCCC1)NCC(O)(C)C	0.07	0.0
Compound_494	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@H](O2)CC(=O)N1CCOC1)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.38	0.0
Compound_495	FCCC(NS(=O)(=O)c1ccc(c2c1cccc2)c1sc(nc1CC1CCCCC1)C(=O)NC1CC(C1)C(=O)O)(C)C	0.08	0.0
Compound_496	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CS(=O)(=O)C(C)(C)C)S(=O)(=O)c1cccc(c1)C(F)(F)F	0.42	0.0
Compound_497	CCn1nc(c(c1)S(=O)(=O)N1C[C@@H](Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)CC(C(=O)O)(CO)C)Cl	0.02	0.0
Compound_498	CC(=O)NC(C[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C)(C)C	0.16	0.0
Compound_499	N#Cc1ccccc1COC(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)C1(CCCC1)S(=O)(=O)c1ccc(cc1)F	0.97	1.0
Compound_500	Fc1ccc(cc1)S(=O)(=O)[C@@]12CCN([C@@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)C(=O)C1CCN(CC1)C(=O)C	0.16	0.0
Compound_501	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)CNS(=O)(=O)C1CC1)S(=O)(=O)c1cccc(c1)S(=O)(=O)C	0.05	0.0
Compound_502	CCCOc1ncccc1c1csc(c1)NC(=O)Cc1ccc(cc1)S(=O)(=O)CC	0.59	1.0
Compound_503	C[C@H]1CC(CCC1C(=O)N1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccccc1)C(=O)O	0.1	0.0
Compound_504	CNS(=O)(=O)NC[C@@H]1Oc2ccc(cc2N(C1)S(=O)(=O)c1ccc(cc1)F)NC(=O)OC(C(F)(F)F)(C)C	0.23	0.0
Compound_505	N#Cc1cc(ccc1c1n(CC)nc(c1Cl)C(=O)NC[C@]1(O)CC[C@H](CC1)S(=O)(=O)C)CC(C(F)(F)F)(C)C	0.07	0.0
Compound_506	CCOc1nn(cc1S(=O)(=O)N1C[C@H](CNC(=O)C(C(F)(F)F)(N)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C(F)F	0.02	0.0
Compound_507	CC(=O)N1CCN(C[C@H]1C)c1ccc2c(c1)CCN(C2)S(=O)(=O)N(Cc1c(F)cccc1Cl)C	0.39	0.0
Compound_508	CCS(=O)(=O)c1ccc(cc1)CNC(=O)c1ccc2c(c1)nc(n2Cc1cccc(c1)OC(F)(F)F)C1CC1	0.19	0.0
Compound_509	O=C(OC(C)(C)C)Nc1ccc2c(c1)N(C[C@@H](O2)Cn1nncc1)S(=O)(=O)c1cn(nc1C)C(F)F	0.23	0.0
Compound_510	CNC(=O)N=c1cc(n([nH]1)C(C)C)c1ccc(c(c1)N1CC2C(C1)C2)N(C(=O)c1c(F)cccc1Cl)C	0.05	0.0
Compound_511	OCCOc1nn(cc1S(=O)(=O)N1C[C@H](CNC(=O)C(C(F)(F)F)(N)C)Oc2c1cc(cc2)NC(=O)OC(C(F)(F)F)(C)C)C(F)F	0.01	0.0
Compound_512	O=C(OC(C(F)(F)F)(C)C)Nc1ccc2c(c1)N(C[C@H](O2)CC1(CC1)C(=O)O)S(=O)(=O)c1ccc(c(c1)C)F	0.09	0.0
Compound_513	CC(CN(S(=O)(=O)c1ccc(cc1)c1ccc(cc1)C(=O)N)c1ccccc1Cl)C	0.58	1.0
Compound_514	O=C(C1N(Cc2c1ccc(c2)S(=O)(=O)CC1CC1)C(=O)C1CCCO1)Nc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O	0.06	0.0
Compound_515	OC[C@@H](CNC(=O)C1CC[C@@]2([C@H]1CCc1c2ccc(c1)C(C(F)(F)F)(C(F)(F)F)F)S(=O)(=O)c1ccc(cc1)F)O	0.03	0.0
Compound_516	OC(=O)c1ccc(c(c1)F)c1nn(c2c1CCOC2)C(=O)c1c(Cl)cccc1C1(CC1)C(F)(F)F	0.04	0.0