Index	SMILES	Probability	Label
Compound_1	COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@H]([C@H](C1)N(C)C)O[C@H]1C[C@H](O)[C@@H]([C@@H](O1)C)O[C@H]1CCC(=O)[C@@H](O1)C)O)C(=O)c1c(C3=O)cccc1O	0.31	0.0
Compound_2	CC[C@H](NCCN[C@H](CO)CC)CO	0.94	1.0
Compound_3	[O-]C(=O)C(c1cccc(c1)Oc1ccccc1)C	0.37	0.0
Compound_4	CC(c1ccccc1)(c1ccc(cc1)Nc1ccc(cc1)C(c1ccccc1)(C)C)C	1.0	1.0
Compound_5	CN(Cc1cccc2c1cccc2)Cc1ccc(cc1)C(C)(C)C	0.02	0.0
Compound_6	O=S(=O)(c1cccc2c1ccnc2)N1CCNCCC1	0.01	0.0