Index	SMILES	Probability	Label
Compound_1	CCCCCCCCCCc1ccc(cc1)S(=O)(=O)[O-]	0.49	0.0
Compound_2	CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)[O-]	0.49	0.0
Compound_3	CCCCCCCCC=CCCCCCCCC(=O)OC	0.93	1.0
Compound_4	CCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)[O-]	0.49	0.0
Compound_5	CCCCOC1OC(CO)C(C(C1O)O)O	0.59	1.0
Compound_6	CCCCCCC(CC=CCCCCCCCC(=O)O)O	0.12	0.0
Compound_7	CCCCCCCCCCCCCCOS(=O)(=O)[O-]	0.95	1.0
Compound_8	CCCCCCCCCCCC(=O)NCCC[N+](CC(CS(=O)(=O)[O-])O)(C)C	0.12	0.0
Compound_9	CCCCCCCCCCCCCC(=O)NCCC[N+](CC(=O)[O-])(C)C	0.01	0.0
Compound_10	CCCCCCCCCCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C	0.3	0.0
Compound_11	CCCCCCCCCCCCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C	0.3	0.0
Compound_12	CCCCCCCC=CCCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C	0.3	0.0
Compound_13	CCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C	0.28	0.0
Compound_14	CCCCCCCCC(=O)N(CC(C(C(C(CO)O)O)O)O)C	0.3	0.0
Compound_15	CCCCCCCCCCC(=O)NCCC[N+](CC(=O)[O-])(C)C	0.01	0.0
Compound_16	CCCCCCCCCCCCC(=O)NCCC[N+](CC(=O)[O-])(C)C	0.01	0.0
Compound_17	CCCCCCCCCCCC(=O)OC(CS(=O)(=O)[O-])C	0.14	0.0
Compound_18	CCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)O	0.44	0.0
Compound_19	CCCCCCCCCCCCCCCCOS(=O)(=O)[O-]	0.95	1.0
Compound_20	CCCCCCCCCCCCCCCC(=O)OCC[N+](CCOC(=O)CCCCCCCCCCCCCCC)(C)C	0.23	0.0
Compound_21	CCCCCCC(OS(=O)(=O)[O-])CC=CCCCCCCCC(=O)O	0.21	0.0