pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.72	IUPAC digitized pKa	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
1.75	IUPAC digitized pKa	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
1.79	IUPAC digitized pKa	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
1.86	IUPAC digitized pKa	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
1.93	IUPAC digitized pKa	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
1.76999998092651	QSARToolbox	0	-1	CC(C)OP(=O)(O)O	CC(C)OP(=O)([O-])O	mol9079	CC(C)OP(=O)(O)O
7.03	IUPAC digitized pKa	-1	-2	CC(C)OP(=O)([O-])O	CC(C)OP(=O)([O-])[O-]	mol9079	CC(C)OP(=O)(O)O
7.02	IUPAC digitized pKa	-1	-2	CC(C)OP(=O)([O-])O	CC(C)OP(=O)([O-])[O-]	mol9079	CC(C)OP(=O)(O)O
7.07	IUPAC digitized pKa	-1	-2	CC(C)OP(=O)([O-])O	CC(C)OP(=O)([O-])[O-]	mol9079	CC(C)OP(=O)(O)O