Index	SMILES	Probability	Label
Compound_1	CCOC(=O)CC(=O)OCC	0.75	1.0
Compound_2	CCOC(=O)CC(=O)CCl	0.9	1.0
Compound_3	CCOC(=O)CC#N	0.93	1.0
Compound_4	CCOC(=O)CBr	0.99	1.0
Compound_5	CCOC(=O)C1=NN(C(=O)C1)c1ccccc1	0.02	0.0
Compound_6	CCOC(=O)c1nn(c(n1)C(Cl)(Cl)Cl)c1ccc(cc1Cl)Cl	0.63	1.0
Compound_7	CCOC(=O)c1ccc(nc1)C#Cc1ccc2c(c1)C(C)(C)CCS2	0.05	0.0
Compound_8	CCOC(=O)c1ccccc1C(=C1C=C(Br)C(=O)C(=C1)Br)c1cc(Br)c(c(c1)Br)O	0.85	1.0
Compound_9	CCOC(=O)c1ccc(cc1)N(C)C	0.93	1.0
Compound_10	CCOC(=O)c1cc(nc2c1cc(C)cc2)c1ccccc1	0.97	1.0
Compound_11	NCCOCC1=C(C(=O)OCC)C(C(=C(N1)C)C(=O)OC)c1ccccc1Cl	0.01	0.0
Compound_12	CCOC(=O)C1=C(C)NC(=C(C1c1ccccc1/C=C/C(=O)OC(C)(C)C)C(=O)OCC)C	0.28	0.0
Compound_13	CCOC(=O)[C@@H](N[C@H]1CCc2c(N(C1=O)CC(=O)O)cccc2)CCc1ccccc1	0.0	0.0
Compound_14	CCOC(=O)/C=C/c1ccccc1	0.99	1.0
Compound_15	CCO[Si](CCC1CCC2C(C1)O2)(OCC)OCC	0.96	1.0
Compound_16	CCO[C@H](C(=O)O)Cc1ccc(cc1)OCCc1ccc(cc1)OS(=O)(=O)C	0.36	0.0
Compound_17	CCNc1nc(NCC)nc(n1)SC	0.68	1.0
Compound_18	CCNc1nc(N)nc(n1)Cl	0.92	1.0
Compound_19	CCNc1ccccc1	0.71	1.0
Compound_20	CCNc1cccc(c1)C	0.66	1.0
Compound_21	CCNC(=S)NCC	0.7	1.0
Compound_22	CCN1CCOCC1	0.53	1.0
Compound_23	CCn1c2ccc(cc2c2c1cccc2)N(=O)=O	0.97	1.0
Compound_24	CC[n+]1c(/C=C/C=c/2\ccc3c(n2CC)cccc3)ccc2c1cccc2	0.13	0.0
Compound_25	CCN(c1ccccc1)Cc1cccc(c1)S(=O)(=O)O	0.61	1.0