pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.59999990463257	QSARToolbox	1	0	O=[N+]([O-])C12CC[NH+](CC1)CC2	O=[N+]([O-])C12CCN(CC1)CC2	mol24560	O=[N+]([O-])C12CCN(CC1)CC2
7.64	AttenGpKa training set	1	0	O=[N+]([O-])C12CC[NH+](CC1)CC2	O=[N+]([O-])C12CCN(CC1)CC2	mol24560	O=[N+]([O-])C12CCN(CC1)CC2