pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.9	Hunt	1	0	CCN(CC)C(=O)[C@@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1	CCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1	mol845	CCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1