pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.02	AttenGpKa training set	1	0	CO[C@@H]1NC=[NH+]c2ccc([N+](=O)[O-])cc21	CO[C@@H]1NC=Nc2ccc([N+](=O)[O-])cc21	mol26271	COC1NC=Nc2ccc([N+](=O)[O-])cc21