pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.33	Datawarrior	1	0	C[C@@H]1CC2CC[NH+]1CC2	C[C@@H]1CC2CCN1CC2	mol13535	CC1CC2CCN1CC2
11.3299999237061	QSARToolbox	1	0	C[C@@H]1CC2CC[NH+]1CC2	C[C@@H]1CC2CCN1CC2	mol13535	CC1CC2CCN1CC2