pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.2	Datawarrior	1	0	[NH3+]NCCCc1ccccc1,N[NH2+]CCCc1ccccc1	NNCCCc1ccccc1	mol14145	NNCCCc1ccccc1
7.1999998	OCHEM	1	0	[NH3+]NCCCc1ccccc1,N[NH2+]CCCc1ccccc1	NNCCCc1ccccc1	mol14145	NNCCCc1ccccc1
7.19999980926514	QSARToolbox	1	0	[NH3+]NCCCc1ccccc1,N[NH2+]CCCc1ccccc1	NNCCCc1ccccc1	mol14145	NNCCCc1ccccc1