pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.85	IUPAC digitized pKa	0	-1	C[NH+](C)CCC(=O)[O-]	CN(C)CCC(=O)[O-]	mol5347	CN(C)CCC(=O)O
9.8500004	OCHEM	0	-1	C[NH+](C)CCC(=O)[O-]	CN(C)CCC(=O)[O-]	mol5347	CN(C)CCC(=O)O
9.85000038146973	QSARToolbox	0	-1	C[NH+](C)CCC(=O)[O-]	CN(C)CCC(=O)[O-]	mol5347	CN(C)CCC(=O)O