pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.85	Datawarrior	1	0	OC[C@@H]1CC2CC[NH+]1CC2	OC[C@@H]1CC2CCN1CC2	mol13191	OCC1CC2CCN1CC2
10.8500003814697	QSARToolbox	1	0	OC[C@@H]1CC2CC[NH+]1CC2	OC[C@@H]1CC2CCN1CC2	mol13191	OCC1CC2CCN1CC2