Index	SMILES	Probability	Label
Compound_1	COc1ccc(c(c1)C)N	0.98	1.0
Compound_2	Oc1ccc(c(c1)C)O	0.99	1.0
Compound_3	Oc1ccc(c(c1)C)N	0.99	1.0
Compound_4	Oc1ccc(c(c1)C)Cl	0.99	1.0
Compound_5	[O-]C(=O)COc1ccc(cc1C)Cl	0.9	1.0
Compound_6	Clc1ccc(c(c1)C)O	0.98	1.0
Compound_7	Nc1ccc(cc1C)c1ccc(c(c1)C)N	1.0	1.0
Compound_8	Oc1ccc(cc1C)C(c1ccc(c(c1)C)O)(C)C	1.0	1.0
Compound_9	O=C=Nc1ccc(c(c1)N=C=O)C	0.34	0.0
Compound_10	Nc1ccc(c(c1)O)C	0.87	1.0
Compound_11	Nc1ccc(c(c1)N)C	0.93	1.0
Compound_12	Nc1ccc(c(c1)C)C	0.99	1.0
Compound_13	O=N(=O)c1ccc(c(c1)N(=O)=O)C	0.99	1.0
Compound_14	OC(=O)CSc1nc(cc(n1)Cl)Nc1cccc(c1C)C	0.05	0.0
Compound_15	CC(=O)OC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C	0.93	1.0
Compound_16	C/C(=C\C=C\C(=C\C(=O)O)\C)/C=C/C1=C(C)CCCC1(C)C	0.02	0.0
Compound_17	Oc1ccc2c(c1)oc(=O)c(c2C)Cl	0.85	1.0
Compound_18	O=c1ccoc(c1O)C	0.3	0.0
Compound_19	O=C(c1n(=O)c2ccccc2n(=O)c1C)C=Cc1ccccc1	0.06	0.0
Compound_20	Nc1c(C)cccc1O	0.96	1.0