pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.1	IUPAC digitized pKa	1	0	N#CCC[NH+](CCC#N)CCC#N	N#CCCN(CCC#N)CCC#N	mol3130	N#CCCN(CCC#N)CCC#N
1.10000002384186	QSARToolbox	1	0	N#CCC[NH+](CCC#N)CCC#N	N#CCCN(CCC#N)CCC#N	mol3130	N#CCCN(CCC#N)CCC#N