Index	SMILES	Probability	Label
Compound_1	CC(OC(=O)Nc1ccccc1)C	0.96	1.0
Compound_2	CC(OC(=O)Nc1cccc(c1)Cl)C	0.99	1.0
Compound_3	CC(OC(=O)C)C	0.92	1.0
Compound_4	CC(O)C	0.14	0.0
Compound_5	CC(Nc1nc(N)nc(n1)Cl)C	0.98	1.0
Compound_6	CC(Nc1nc(NC(C)C)nc(n1)Cl)C	0.96	1.0
Compound_7	CC(Nc1ccc(cc1)Nc1ccccc1)C	0.33	0.0
Compound_8	CC(NC(=O)N1CC(=O)N(C1=O)c1cc(Cl)cc(c1)Cl)C	0.83	1.0
Compound_9	CC(Cn1c(=O)n(C)c(=O)c2c1nc[nH]2)C	0.85	1.0
Compound_10	CC(CCOC(=O)c1ccccc1)C	0.96	1.0
Compound_11	CC(CCOC(=O)C)C	0.87	1.0
Compound_12	OCCC(C)C	0.87	1.0
Compound_13	C=CC(=O)OCCCCCC(C)C	0.99	1.0
Compound_14	CC(CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C)C	0.67	1.0
Compound_15	CC(CCCCCCOC(=O)C1CCCCC1C(=O)OCCCCCCC(C)C)C	0.85	1.0
Compound_16	CC(CCCCCCc1ccc(cc1)O)C	0.53	1.0
Compound_17	CC(CCC(=O)C)C	0.68	1.0
Compound_18	CC(Cc1ccccc1)C	0.97	1.0
Compound_19	CSC(=O)c1c(nc(c(c1CC(C)C)C(=O)SC)C(F)(F)F)C(F)F	0.83	1.0
Compound_20	COC(=O)c1c(nc(c(c1CC(C)C)C1=NCCS1)C(F)(F)F)C(F)F	0.02	0.0