pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.7	Datawarrior	1	0	COc1ccc([C@H]2C[NH2+]2)cc1	COc1ccc([C@H]2CN2)cc1	mol14024	COc1ccc(C2CN2)cc1
8.6999998	OCHEM	1	0	COc1ccc([C@H]2C[NH2+]2)cc1	COc1ccc([C@H]2CN2)cc1	mol14024	COc1ccc(C2CN2)cc1
8.69999980926514	QSARToolbox	1	0	COc1ccc([C@H]2C[NH2+]2)cc1	COc1ccc([C@H]2CN2)cc1	mol14024	COc1ccc(C2CN2)cc1