Index SMILES Probability Label Compound_1 CC(c1cc(C)c(c(c1)C)O)(c1cc(C)c(c(c1)C)O)C 1.0 1.0 Compound_2 O=C(Nc1ccc(c(c1)Cl)Cl)Nc1ccc(cc1)Cl 0.96 1.0 Compound_3 Brc1cc(cc(c1O)Br)S(=O)(=O)c1cc(Br)c(c(c1)Br)O 0.95 1.0 Compound_4 CCCCCCCCCc1ccc(cc1)O 0.97 1.0 Compound_5 Oc1ccc(cc1)C(=C)CC(c1ccc(cc1)O)(C)C 0.95 1.0 Compound_6 Oc1ccc(cc1C)C(c1ccc(c(c1)C)O)(C)C 1.0 1.0 Compound_7 O=C(c1ccc(cc1)O)c1ccc(cc1)O 1.0 1.0 Compound_8 Oc1ccc(cc1C)S(=O)(=O)c1ccc(c(c1)C)O 0.93 1.0 Compound_9 CC(Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O)C 0.92 1.0 Compound_10 C[C@H]1CC(C)(C)CC(C1)(c1ccc(cc1)O)c1ccc(cc1)O 0.97 1.0 Compound_11 Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)OCc1ccccc1 0.95 1.0 Compound_12 C=CCOc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O 0.88 1.0 Compound_13 Oc1ccc(cc1c1ccccc1)C(c1ccc(c(c1)c1ccccc1)O)(C)C 1.0 1.0 Compound_14 CC(c1ccc(cc1)O)(c1cccc(c1)C(c1ccc(cc1)O)(C)C)C 1.0 1.0 Compound_15 CC(c1cc(ccc1O)C(c1ccc(c(c1)C(C)C)O)(C)C)C 1.0 1.0 Compound_16 Oc1ccc(cc1)Cc1ccc(c(c1)O)O 0.99 1.0 Compound_17 Oc1ccc(cc1)Cc1ccc(cc1O)O 0.99 1.0 Compound_18 CC(c1ccc(cc1)O)(c1ccc(cc1)C(c1ccc(cc1)O)(C)C)C 1.0 1.0 Compound_19 Oc1ccc(cc1)C(c1ccc(cc1)O)(c1ccccc1)c1ccccc1 1.0 1.0 Compound_20 Oc1ccc(cc1)C(c1ccc(cc1)O)(c1ccccc1)C 1.0 1.0 Compound_21 Oc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)OC1OC(C(=O)O)C(C(C1O)O)O 0.71 1.0 Compound_22 O=C(C(=C)C)Oc1ccc(cc1)C(c1ccc(cc1)OC(=O)C(=C)C)(C)C 0.97 1.0 Compound_23 OC(=O)C(c1ccc(cc1)O)(c1ccc(cc1)O)C 0.54 1.0 Compound_24 CC(c1ccc(cc1)O)(c1ccc(cc1)O)C 1.0 1.0 Compound_25 OCC(c1ccc(cc1)O)(c1ccc(cc1)O)C 0.98 1.0 Compound_26 Oc1ccc(cc1)C(c1ccc(c(c1)O)O)(C)C 0.99 1.0 Compound_27 OC(COC(=O)C(=C)C)COc1ccc(cc1)C(c1ccc(cc1)OCC(COC(=O)C(=C)C)O)(C)C 0.69 1.0 Compound_28 OCCOc1ccc(cc1)S(=O)(=O)c1ccc(cc1)OCCO 0.52 1.0 Compound_29 CC(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)(c1ccc(cc1)OP(=O)(Oc1ccccc1)Oc1ccccc1)C 0.98 1.0 Compound_30 Oc1ccc(cc1)C(c1ccccc1O)(C)C 1.0 1.0 Compound_31 Oc1ccccc1C(c1ccccc1O)(C)C 1.0 1.0 Compound_32 Oc1ccc(cc1)S(=O)(=O)c1ccccc1O 0.85 1.0