pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.8	IUPAC digitized pKa	0	-1	Oc1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1O	mol769	Oc1ccccc1-c1ccccc1O
13.7	AttenGpKa training set	0	-1	Oc1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1O	mol769	Oc1ccccc1-c1ccccc1O
7.56	IUPAC digitized pKa	-1	-2	[O-]c1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1[O-]	mol769	Oc1ccccc1-c1ccccc1O
8.36	IUPAC digitized pKa	-1	-2	[O-]c1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1[O-]	mol769	Oc1ccccc1-c1ccccc1O
7.5	OCHEM	-1	-2	[O-]c1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1[O-]	mol769	Oc1ccccc1-c1ccccc1O
7.6	AttenGpKa training set	-1	-2	[O-]c1ccccc1-c1ccccc1O	[O-]c1ccccc1-c1ccccc1[O-]	mol769	Oc1ccccc1-c1ccccc1O
