pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.25	AttenGpKa training set	0	-1	CCN(CC)c1ccc(C=O)c(O)c1	CCN(CC)c1ccc(C=O)c([O-])c1	mol30628	CCN(CC)c1ccc(C=O)c(O)c1