pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.24	Datawarrior	1	0	CN1CCCCCC[NH+](C)CCCCCC1	CN1CCCCCCN(C)CCCCCC1	mol14438	CN1CCCCCCN(C)CCCCCC1
9.2399998	OCHEM	1	0	CN1CCCCCC[NH+](C)CCCCCC1	CN1CCCCCCN(C)CCCCCC1	mol14438	CN1CCCCCCN(C)CCCCCC1
9.23999977111816	QSARToolbox	1	0	CN1CCCCCC[NH+](C)CCCCCC1	CN1CCCCCCN(C)CCCCCC1	mol14438	CN1CCCCCCN(C)CCCCCC1