pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.25	AttenGpKa training set	0	-1	Nc1ccc([N+](=O)[O-])cc1O	Nc1ccc([N+](=O)[O-])cc1[O-]	mol23752	Nc1ccc([N+](=O)[O-])cc1O
1.06	AttenGpKa training set	1	0	[NH3+]c1ccc([N+](=O)[O-])cc1O	Nc1ccc([N+](=O)[O-])cc1O	mol23752	Nc1ccc([N+](=O)[O-])cc1O