pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.4	IUPAC digitized pKa	1	0	CC[NH+](CC)CCC(=O)Cc1ccccc1	CCN(CC)CCC(=O)Cc1ccccc1	mol857	CCN(CC)CCC(=O)Cc1ccccc1
9.39999961853027	QSARToolbox	1	0	CC[NH+](CC)CCC(=O)Cc1ccccc1	CCN(CC)CCC(=O)Cc1ccccc1	mol857	CCN(CC)CCC(=O)Cc1ccccc1