pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.6	Datawarrior	1	0	C1CCC[NH2+]CCCCCCNCC1	C1CCCNCCCCCCNCC1	mol13228	C1CCCNCCCCCCNCC1
9.6000004	OCHEM	1	0	C1CCC[NH2+]CCCCCCNCC1	C1CCCNCCCCCCNCC1	mol13228	C1CCCNCCCCCCNCC1
9.60000038146973	QSARToolbox	1	0	C1CCC[NH2+]CCCCCCNCC1	C1CCCNCCCCCCNCC1	mol13228	C1CCCNCCCCCCNCC1