pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.92	IUPAC digitized pKa	0	-1	Cc1cc(O)nc2c1CCO2	Cc1cc([O-])nc2c1CCO2	mol7812	Cc1cc(O)nc2c1CCO2
8.44	Datawarrior	0	-1	Cc1cc(O)nc2c1CCO2	Cc1cc([O-])nc2c1CCO2	mol7812	Cc1cc(O)nc2c1CCO2
8.4399996	OCHEM	0	-1	Cc1cc(O)nc2c1CCO2	Cc1cc([O-])nc2c1CCO2	mol7812	Cc1cc(O)nc2c1CCO2
2.42	Datawarrior	1	0	Cc1cc(O)[nH+]c2c1CCO2	Cc1cc(O)nc2c1CCO2	mol7812	Cc1cc(O)nc2c1CCO2
2.4200001	OCHEM	1	0	Cc1cc(O)[nH+]c2c1CCO2	Cc1cc(O)nc2c1CCO2	mol7812	Cc1cc(O)nc2c1CCO2