Index SMILES Probability Label Compound_1 COC(=O)CCCCCCCCC(=O)OC 0.6 1.0 Compound_2 COC(=O)CCC(=O)OC 0.38 0.0 Compound_3 COC(=O)Cc1ccccc1 0.96 1.0 Compound_4 COC(=O)CC#N 0.87 1.0 Compound_5 COC(=O)c1cccc(c1)C(=O)OC 0.92 1.0 Compound_6 COC(=O)C(CBr)Br 0.99 1.0 Compound_7 CNS(=O)(=O)Cc1ccc2c(c1)c(CCN(C)C)c[nH]2 0.0 0.0 Compound_8 CNCCCC12CCC(c3c1cccc3)c1c2cccc1 0.05 0.0 Compound_9 CNc1ccccc1 0.98 1.0