Index SMILES Probability Label Compound_1 Oc1cc(C)c(c(c1)C)Cl 0.97 1.0 Compound_2 CCCCCCC(CC=CCCCCCCCC(=O)O)O 0.12 0.0 Compound_3 CC(=O)N(C(=O)C)CCN(C(=O)C)C(=O)C 0.19 0.0 Compound_4 CC(P(=O)(O)O)(P(=O)(O)O)O 0.02 0.0 Compound_5 CC(c1ccc(cc1)S(=O)(=O)O)C 0.4 0.0 Compound_6 CCCCCCCCCCCC(=O)NCCC[N+](CC(=O)[O-])(C)C 0.01 0.0 Compound_7 CS(=O)(=O)C 0.92 1.0 Compound_8 CCCCCCCCCCCCCCCCCCO 0.98 1.0 Compound_9 OCCN(CCO)CCO 0.75 1.0 Compound_10 C[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C 0.08 0.0 Compound_11 CCCCCCCCCCCCCCCCCC(=O)OCCOC(=O)CCCCCCCCCCCCCCCCC 0.49 0.0 Compound_12 CC(=C1CCC(CC1)(C)O)C 0.09 0.0 Compound_13 OCC(CO)(CO)CO 0.38 0.0 Compound_14 CC(P(=O)(O)O)(P(=O)(O)O)O 0.02 0.0 Compound_15 OCCN(CC(=O)O)CC(=O)O 0.05 0.0