pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.92000007629395	QSARToolbox	1	0	CCCCCC[NH+]1CCN(c2ncccn2)CC1	CCCCCCN1CCN(c2ncccn2)CC1	mol24662	CCCCCCN1CCN(c2ncccn2)CC1
8.02	AttenGpKa training set	1	0	CCCCCC[NH+]1CCN(c2ncccn2)CC1	CCCCCCN1CCN(c2ncccn2)CC1	mol24662	CCCCCCN1CCN(c2ncccn2)CC1