Index	SMILES	Probability	Label
Compound_1	CCc1cc(C(=O)O)c2n(c1)c(cn2)C#CC12CCC(CC1)(CC2)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1	0.11	0.0
Compound_2	CCc1nc(cc2c1cc(OCC13CCC(CC1)(CC3)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1)cc2)C(=O)O	0.21	0.0
Compound_3	Brc1ccc2c(c1)C1(CCN(CC1)S(=O)(=O)c1c(Cl)cccc1Cl)C(=O)N2Cc1ccc(cc1)C(=O)O	0.14	0.0
Compound_4	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CCC(C3(C)CC[C@@H]2C2(C1C[C@H](O)CC2)C)[C@@H](CCC(=O)NS(=O)(=O)c1ccc2c(c1)OCO2)C	0.3	0.0
Compound_5	Clc1cc(ccc1C1CC1c1ccc2c(c1)n(C)nc2C(=O)O)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.28	0.0
Compound_6	O=C1C2C[C@H](N1c1ccc(c(c1)F)C(=O)NS(=O)(=O)CCC1COCC1)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.09	0.0
Compound_7	CCOC(=O)C1=CN(CC(c2c1[nH]c1c2cccc1)C)C(=O)c1ccc(cc1)F	0.04	0.0
Compound_8	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)N1CCC(CC1)(CC)CO)C	0.06	0.0
Compound_9	COc1ccc(cc1C(=O)NS(=O)(=O)C)c1noc(n1)C12CCC(CC1)(CC2)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1	0.07	0.0
Compound_10	OC(=O)c1cc(OC2CC2)c2c(c1)sc(n2)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(C)cccc1Cl)C1CC1	0.13	0.0
Compound_11	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NS(=O)(=O)c1ccc(c(c1)OC)OC)C	0.29	0.0
Compound_12	O=C(c1c(onc1c1c(Cl)cccc1Cl)C1CC1)O[C@@H]1C[C@@H]2CC[C@H](C1)N2c1sc2c(n1)c(cc(c2)C(=O)O)C1CC1	0.07	0.0
Compound_13	O=C1C2C[C@H](N1c1cc(ccc1C(=O)O)C1CC1)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.07	0.0
Compound_14	OC(=O)Cc1ccc(c(c1)F)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.05	0.0
Compound_15	OC(=O)C1CC1c1noc(n1)C12CCC(CC1)(CC2)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1	0.01	0.0
Compound_16	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)c1cc(F)cc(c1)OC)C	0.04	0.0
Compound_17	OC(=O)c1ccc(cc1)N1[C@H]2CC(C1=O)[C@@H](C2)OCc1c(onc1c1c(C)cccc1Cl)C1CC1	0.04	0.0
Compound_18	OC(=O)c1cc2sc(nc2c(c1)C1CCOCCC1)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.13	0.0
Compound_19	Cc1cc(ccc1/C=C/c1cccc(c1)C(=O)O)OCc1c(onc1c1c(Cl)cccc1Cl)C(C)C	0.7	1.0
Compound_20	COc1cc(ccc1OCC12CCC(CC1)(CC2)/C=C/c1c(onc1c1c(Cl)cncc1Cl)C1CC1)C(=O)O	0.6	1.0
Compound_21	O=C1C2C[C@H](N1c1ccc(c(c1)F)C(=O)O[C@@H]1CCC[C@H]1S(=O)(=O)N)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.1	0.0
Compound_22	CC(=O)OCCS(=O)(=O)NC(=O)c1ccc(cc1)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.05	0.0
Compound_23	CN1CCN(CC1)c1nc(cc2c1cc(/C=C/C13CCC(CC1)(CC3)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1)cc2)C(=O)O	0.01	0.0
Compound_24	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NS(=O)(=O)C)C	0.29	0.0
Compound_25	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](COC(=O)NS(=O)(=O)c1ccc(cc1)C1CCCCC1)C	0.2	0.0
Compound_26	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NS(=O)(=O)c1ccc(s1)c1ccccc1)C	0.62	1.0
Compound_27	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](COC(=O)NS(=O)(=O)c1ccc(cc1)c1ccccc1)C	0.28	0.0
Compound_28	Fc1ccc2c(c1)n(C1CC1)c(n2)C(n1c(O)cn(c1=O)c1ccc(cc1)Oc1ccc(cc1)F)CC1CCN(CC1)C(=O)C(C)C	0.01	0.0
Compound_29	Cc1ccc2c(c1)n(C)c(n2)C(n1c(O)cn(c1=O)c1ccc(cc1)Oc1ccc(cc1)F)CC1CCN(CC1)C(=O)C(C)C	0.01	0.0
Compound_30	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)c1ccc2c(c1)CCCC2)C	0.03	0.0
Compound_31	OC(=O)c1ncc(cc1OC1CCC1)OCC12CCC(CC1)(CC2)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1	0.14	0.0
Compound_32	OC(=O)CNC(=O)c1ccc(cc1F)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.02	0.0
Compound_33	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NS(=O)(=O)c1ccc(cc1)C(CO)(C)C)C	0.17	0.0
Compound_34	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)N1CC[C@H](C1)O)C	0.05	0.0
Compound_35	O=C1C2C[C@H](N1c1ccc(cc1)C(=O)NS(=O)(=O)CCC1COCC1)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.06	0.0
Compound_36	Fc1cc(ccc1N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(noc1C1(F)CC1)c1c(Cl)cccc1Cl)C(=O)O	0.09	0.0
Compound_37	Clc1cncc(c1c1noc(c1COC12CCC(CC1)(CC2)c1onc(n1)c1ccc(c(c1)C(=O)O)F)C1CC1)Cl	0.07	0.0
Compound_38	Clc1ccc(cc1)c1nc2c(n1[C@@H](C1CCCCC1)COc1ccc(cc1)C(=O)O)cc(c(c2)F)F	0.24	0.0
Compound_39	CC(OC(=O)C1=CN(CC(c2c1[nH]c1c2ccc(c1)F)(C)C)C(=O)c1ccc(cc1)OCCN1CCOCC1)C	0.01	0.0
Compound_40	O=C(c1c(onc1c1c(Cl)cccc1Cl)C1CC1)O[C@@H]1C[C@@H]2C[C@H]1CN2c1sc2c(n1)c(OCC(F)(F)F)cc(c2)C(=O)O	0.17	0.0
Compound_41	CCOc1cc(cc2c1nc(s2)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)C(=O)O	0.23	0.0
Compound_42	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCCOC(=O)NCc1ccccc1)C	0.03	0.0
Compound_43	Clc1cncc(c1c1noc(c1COC12CCC(CC1)(CC2)C#Cc1ccc(c2c1nccc2)C(=O)O)C1CC1)Cl	0.17	0.0
Compound_44	Clc1cncc(c1c1noc(c1COC12CCC(CC1)(CC2)COc1cc(n(n1)CC1CC1)C(=O)O)C1CC1)Cl	0.06	0.0
Compound_45	OC(=O)c1ccc2c(c1)sc(n2)N1CCC(CC1)OCc1c(onc1c1ccccc1C(F)(F)F)C1CC1	0.06	0.0
Compound_46	Clc1cc(OCc2c(noc2C(C)C)COc2c(C)cccc2C)ccc1/C=C/c1cccc(c1)C(=O)O	0.21	0.0
Compound_47	Fc1cccc(c1c1noc(c1COC1CCN(CC1)c1nc2c(s1)cc(cc2)C(=O)O)C1CC1)F	0.13	0.0
Compound_48	Clc1cccc(c1c1noc(c1CO[C@H]1C[C@H]2C[C@@H]1CN2c1sc2c(n1)c(cc(c2)C(=O)O)C1CCCC1)C1CC1)Cl	0.16	0.0
Compound_49	COc1cc(cc2c1nc(s2)N1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c(onc1c1c(Cl)cccc1Cl)C1CC1)C(=O)O	0.3	0.0
Compound_50	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)C[C@]12CCC(C1(C)C)CC2=O)C	0.05	0.0
Compound_51	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](COC(=O)NS(=O)(=O)c1ccc(cc1)N1CCC1)C	0.08	0.0
Compound_52	COCc1cc(C#CC23CCC(CC2)(CC3)OCc2c(onc2c2c(Cl)cncc2Cl)C2CC2)cc(c1)C(=O)O	0.14	0.0
Compound_53	CC1=Cc2ccc(cc2Oc2c1nc(cc2)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)C(=O)O	0.2	0.0
Compound_54	OC(=O)c1cccc(c1)c1noc(n1)C12CCC(CC1)(CC2)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.1	0.0
Compound_55	Cc1cc(ccc1c1ccc2c(c1)n(C)cc2C(=O)O)OCc1c(onc1c1c(Cl)cncc1Cl)C(C)C	0.87	1.0
Compound_56	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NS(=O)(=O)c1ccc(s1)C(C)(C)C)C	0.28	0.0
Compound_57	OC(=O)c1cccc(c1)c1noc(n1)C12CCC(CC1)(CC2)/C=C/c1c(onc1c1c(Cl)cncc1Cl)C1CC1	0.06	0.0
Compound_58	O=C(c1ccc(cc1)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)NS(=O)(=O)C1CCC1	0.09	0.0
Compound_59	O=C(c1ccc(cc1)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)NS(=O)(=O)C1CC1	0.05	0.0
Compound_60	O=C1C2C[C@H](N1c1ccc(cc1)C(=O)NCCS(=O)(=O)O)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.07	0.0
Compound_61	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)c1ccc(s1)C(C)(C)C)C	0.04	0.0
Compound_62	Clc1cccc(c1c1noc(c1CCC1CCN(CC1)c1sc2c(n1)c(F)cc(c2)C(=O)O)C1CC1)Cl	0.15	0.0
Compound_63	OC(=O)c1cc(C)c2c(c1)sc(n2)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(C)cccc1Cl)C1CC1	0.19	0.0
Compound_64	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)N1CCC(CC1)(C)C)C	0.06	0.0
Compound_65	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)N1CCC(CC1)(CO)CO)C	0.11	0.0
Compound_66	Clc1cccc(c1c1noc(c1COC12CCC(CC1)(CC2)Cn1nc(c(c1)C(=O)O)C(F)F)C1CC1)Cl	0.24	0.0
Compound_67	O=C1C2C[C@H](N1c1ccc(cc1)C(=O)NS(=O)(=O)C1CCOCC1)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.07	0.0
Compound_68	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCCOC(=O)NS(=O)(=O)N(C)C)C	0.1	0.0
Compound_69	O=C(NS(=O)(=O)C1CCOCC1)CCc1ccc(c(c1)F)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.06	0.0
Compound_70	CN(c1ccc(nc1C(F)(F)F)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1)Cc1ccc(cc1)C(=O)NCCS(=O)(=O)O	0.38	0.0
Compound_71	Clc1cccc(c1c1noc(c1CO[C@@H]1C[C@@H]2C[C@H]1CN2c1ccc(cc1)C(=O)C(F)(F)F)C1CC1)Cl	0.24	0.0
Compound_72	N#Cc1cc(CCC(=O)O)ccc1N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.01	0.0
Compound_73	O=C(NS(=O)(=O)C)CCc1ccc(c(c1)F)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.05	0.0
Compound_74	COC(=O)/C=C/c1cccc(c1)N(C(=O)C1CCCCC1)Cc1ccc(cc1)c1cccc(c1)Cl	0.3	0.0
Compound_75	OC(=O)c1cc(O[C@H]2COCC2)c2c(c1)sc(n2)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.11	0.0
Compound_76	Clc1cccc(c1c1noc(c1CO[C@@H]1C[C@@H]2C[C@H]1CN2c1sc2c(n1)c(cc(c2)C(=O)O)C(F)(F)F)C1CC1)Cl	0.26	0.0
Compound_77	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](COC(=O)NS(=O)(=O)c1ccc(s1)c1ccccc1)C	0.55	1.0
Compound_78	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CNC(=O)NS(=O)(=O)c1cccc(c1)OC(F)(F)F)C	0.06	0.0
Compound_79	O=C(C(n1c(nc2c1cc(F)c(c2)F)c1ccc(cc1)Cl)C1CCCCC1)Nc1ccc(cc1F)C(=O)O	0.06	0.0
Compound_80	O=C(C(n1c(nc2c1cccc2)c1ccc(cc1)Cl)C1CCCCC1)Nc1ccc(cc1C(F)(F)F)C(=O)O	0.04	0.0
Compound_81	OC(=O)c1cccc(c1)[C@@H]1C[C@@H](C1)c1ccc(cc1Cl)OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.55	1.0
Compound_82	Clc1cccc(c1c1noc(c1C1=CC2(C1)CCN(CC2)c1ccc2c(c1)n(C)cc2C(=O)O)C1CC1)Cl	0.06	0.0
Compound_83	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)NCc1ccc(cc1)C(=O)O)C	0.02	0.0
Compound_84	CCc1onc(c1COc1ccc(c(c1)Cl)/C=C/c1cccc(c1)C(=O)O)c1c(F)cccc1C(F)(F)F	0.64	1.0
Compound_85	CC(OC(=O)C1=CN(CC(c2c1[nH]c1c2cc(cc1)F)(C)C)C(=O)c1ccc(c(c1)F)F)C	0.05	0.0
Compound_86	Clc1cccc(c1)c1nc2n(c1NCc1ccccc1)cc(cc2)C	0.47	0.0
Compound_87	O=C(C(F)(F)F)Nc1ccc(c(c1)Cl)CNC(=O)c1ccc(cc1)C(C)(C)C	0.66	1.0
Compound_88	Fc1cc(ccc1N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(noc1C1(F)CC1)c1c(Cl)cccc1Cl)C(=O)NS(=O)(=O)C1CC1	0.1	0.0
Compound_89	Fc1cc(ccc1N1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c1c(onc1c1c(Cl)cccc1Cl)C1CC1)C(=O)NS(=O)(=O)C	0.05	0.0
Compound_90	O=C(C(n1c(nc2c1cc(F)c(c2)F)c1ccc(cc1)Cl)C1CCCCC1)NC1CCCCC1	0.11	0.0
Compound_91	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)C1CC2CC1CC2)C	0.07	0.0
Compound_92	CC(COc1cc(nc2c1cc(OCC13CCC(CC1)(CC3)OCc1c(onc1c1c(Cl)cncc1Cl)C1CC1)cc2)C(=O)O)C	0.33	0.0
Compound_93	O=C1C2C[C@H](N1c1sc3c(n1)c(cc(c3)C(=O)O)C1COCC1)C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.21	0.0
Compound_94	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CCC(C3(C)CC[C@@H]2C2(C1C[C@H](O)CC2)C)[C@@H](CCC(=O)NS(=O)(=O)c1ccc(c(c1)F)C)C	0.04	0.0
Compound_95	CC(OC(=O)C)CCS(=O)(=O)NC(=O)c1ccc(cc1)N1C[C@@H]2C[C@H]1C[C@H]2OCc1c(onc1c1c(Cl)cccc1Cl)C1CC1	0.07	0.0
Compound_96	CC(=O)NCCN(C(=O)c1nn(c2c1COc1c2cc(cc1)Br)C)Cc1cccc(c1)F	0.07	0.0
Compound_97	CC(=O)NCCN(C(=O)c1nn(c2c1COc1c2cc(cc1)I)C)Cc1ccccc1	0.11	0.0
Compound_98	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)N1C(C)CCC1C)C	0.03	0.0
Compound_99	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCCOC(=O)NS(=O)(=O)C(C)(C)C)C	0.22	0.0
Compound_100	CC(=O)NCCN(C(=O)c1nn(c2c1COc1c2cc(cc1)Br)C)Cc1ccccc1F	0.05	0.0
Compound_101	OC(=O)CCc1cccc(c1)NC(=O)c1ccccc1NC(=O)c1ccc(cc1)C(C)(C)C	0.22	0.0
Compound_102	N#Cc1[nH]c2c(c1)C(C)(C)CN(C=C2C(=O)OC(C)C)C(=O)C1CCCCC1	0.02	0.0
Compound_103	CCOC(=O)C1=CN(CC(c2c1[nH]c1c2cccc1)(C)C)C(=O)c1ccc(cc1)Cl	0.11	0.0
Compound_104	CC(c1onc(c1COc1ccc(cc1)c1ccc2c(c1)scc2C(=O)O)c1c(Cl)cccc1Cl)C	0.69	1.0
Compound_105	CC[C@H]1C[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCNC(=O)NS(=O)(=O)c1cccc(c1)Cl)C	0.03	0.0
Compound_106	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)N(OC)C)C	0.58	1.0
Compound_107	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCOC(=O)N1CCC(CC1)(CO)CCl)C	0.13	0.0
Compound_108	CC[C@H]1[C@@H](O)[C@H]2[C@@H]3CC[C@@H]([C@@]3(C)CC[C@@H]2[C@@]2([C@H]1C[C@H](O)CC2)C)[C@@H](CCCOC(=O)NS(=O)(=O)c1cccc(c1)C(C)(C)C)C	0.27	0.0
Compound_109	Clc1cncc(c1c1noc(c1COC12CCC(CC1)(CC2)COc1ccc(c2c1nccc2)C(=O)O)C1CC1)Cl	0.18	0.0