pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.9	IUPAC digitized pKa	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.85	IUPAC digitized pKa	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.7	Datawarrior	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.98	Organic Oxygen Acids and Nitrogen Bases	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.99	OCHEM	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.6999998	OCHEM	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.875	OCHEM	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.97999954223633	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.93000030517578	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
10.7200002670288	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.19999980926514	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
10.3299999237061	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.89999961853027	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O
9.85000038146973	QSARToolbox	0	-1	COc1ccccc1O	COc1ccccc1[O-]	mol9971	COc1ccccc1O