pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.69999980926514	QSARToolbox	1	0	CC[NH+]1CCN(c2ncccn2)CC1,CCN1CC[NH+](c2ncccn2)CC1	CCN1CCN(c2ncccn2)CC1	mol24615	CCN1CCN(c2ncccn2)CC1
7.8	AttenGpKa training set	1	0	CC[NH+]1CCN(c2ncccn2)CC1,CCN1CC[NH+](c2ncccn2)CC1	CCN1CCN(c2ncccn2)CC1	mol24615	CCN1CCN(c2ncccn2)CC1