pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.35	AttenGpKa training set	-1	-2	CCO[P@](=O)([O-])O[C@H]1C[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1CO	CCO[P@](=O)([O-])O[C@H]1C[C@H](n2ccc(=O)[n-]c2=O)O[C@@H]1CO	mol29897	CCOP(=O)(O)O[C@H]1C[C@H](n2ccc(=O)[nH]c2=O)O[C@@H]1CO