pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.09000015258789	QSARToolbox	1	0	CCCCC[NH+]1CCN(c2ncccn2)CC1,CCCCCN1CC[NH+](c2ncccn2)CC1	CCCCCN1CCN(c2ncccn2)CC1	mol24654	CCCCCN1CCN(c2ncccn2)CC1
8.19	AttenGpKa training set	1	0	CCCCC[NH+]1CCN(c2ncccn2)CC1,CCCCCN1CC[NH+](c2ncccn2)CC1	CCCCCN1CCN(c2ncccn2)CC1	mol24654	CCCCCN1CCN(c2ncccn2)CC1