pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.02000045776367	QSARToolbox	1	0	[NH3+]CCNc1ccc([N+](=O)[O-])cc1	NCCNc1ccc([N+](=O)[O-])cc1	mol35268	NCCNc1ccc([N+](=O)[O-])cc1