pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.94	IUPAC digitized pKa	0	-1	CCc1ccc(C(=O)O)nc1,CCc1ccc(C(=O)[O-])[nH+]c1	CCc1ccc(C(=O)[O-])nc1	mol10642	CCc1ccc(C(=O)O)nc1
5.86	Datawarrior	0	-1	CCc1ccc(C(=O)O)nc1,CCc1ccc(C(=O)[O-])[nH+]c1	CCc1ccc(C(=O)[O-])nc1	mol10642	CCc1ccc(C(=O)O)nc1
5.8600001	OCHEM	0	-1	CCc1ccc(C(=O)O)nc1,CCc1ccc(C(=O)[O-])[nH+]c1	CCc1ccc(C(=O)[O-])nc1	mol10642	CCc1ccc(C(=O)O)nc1
5.8600001335144	QSARToolbox	0	-1	CCc1ccc(C(=O)O)nc1,CCc1ccc(C(=O)[O-])[nH+]c1	CCc1ccc(C(=O)[O-])nc1	mol10642	CCc1ccc(C(=O)O)nc1