pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.0	IUPAC digitized pKa	1	0	C[NH+](C)CCC#N	CN(C)CCC#N	mol192	CN(C)CCC#N
7.01	Datawarrior	1	0	C[NH+](C)CCC#N	CN(C)CCC#N	mol192	CN(C)CCC#N
7.0100002	OCHEM	1	0	C[NH+](C)CCC#N	CN(C)CCC#N	mol192	CN(C)CCC#N
6.8899998664856	QSARToolbox	1	0	C[NH+](C)CCC#N	CN(C)CCC#N	mol192	CN(C)CCC#N
7.03000020980835	QSARToolbox	1	0	C[NH+](C)CCC#N	CN(C)CCC#N	mol192	CN(C)CCC#N