pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.25	QSARToolbox	1	0	CCC(CC[NH3+])([N+](=O)[O-])[N+](=O)[O-]	CCC(CCN)([N+](=O)[O-])[N+](=O)[O-]	mol35143	CCC(CCN)([N+](=O)[O-])[N+](=O)[O-]