Index	SMILES	Probability	Label
Compound_1	CCOC(=O)n1ccn(c1=S)C	0.05	0.0
Compound_2	Clc1ccc(cc1)C1(O)c2ccccc2C2=NCCN12	0.0	0.0
Compound_3	Clc1ccc2c(c1)N(C(=O)CC(=O)N2C)c1ccccc1	0.05	0.0
Compound_4	CCC1C(=NN=C(c2c1cc(OC)c(c2)OC)c1ccc(c(c1)OC)OC)C	0.64	1.0
Compound_5	Fc1ccc(c(c1)F)c1ccc(c(c1)C(=O)O)O	0.04	0.0
Compound_6	OC(COc1cc(C)c(c(c1C)C)OC(=O)C)CNC(C)C	0.05	0.0
Compound_7	COC(=O)C(NC(=O)C(CC(=O)O)N)Cc1ccccc1	0.02	0.0
Compound_8	Clc1ccc(c(c1)Cl)COC(c1ccc(cc1Cl)Cl)Cn1cncc1	0.93	1.0
Compound_9	OC(c1cc(O)cc(c1)O)CNC(C)(C)C	0.0	0.0
Compound_10	Clc1ccc2c(c1)C(=NCC(=O)N2CC(F)(F)F)c1ccccc1	0.02	0.0