pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.7	IUPAC digitized pKa	1	0	CC(=O)N(N)C1CC[NH+](C)CC1	CC(=O)N(N)C1CCN(C)CC1	mol5795	CC(=O)N(N)C1CCN(C)CC1
8.6999998	OCHEM	1	0	CC(=O)N(N)C1CC[NH+](C)CC1	CC(=O)N(N)C1CCN(C)CC1	mol5795	CC(=O)N(N)C1CCN(C)CC1
8.69999980926514	QSARToolbox	1	0	CC(=O)N(N)C1CC[NH+](C)CC1	CC(=O)N(N)C1CCN(C)CC1	mol5795	CC(=O)N(N)C1CCN(C)CC1