pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.6999998092651	QSARToolbox	0	-1	CC1=C[C@@H]2CC[C@H](O)[C@@H]2N1C	CC1=C[C@@H]2CC[C@H]([O-])[C@@H]2N1C	mol37610	CC1=C[C@@H]2CC[C@H](O)[C@@H]2N1C