pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.95	IUPAC digitized pKa	0	-1	OCc1ccncc1O,[O-]c1c[nH+]ccc1CO	[O-]c1cnccc1CO	mol3720	OCc1ccncc1O
8.94999980926514	QSARToolbox	0	-1	OCc1ccncc1O,[O-]c1c[nH+]ccc1CO	[O-]c1cnccc1CO	mol3720	OCc1ccncc1O
5.0	IUPAC digitized pKa	1	0	OCc1cc[nH+]cc1O	OCc1ccncc1O,[O-]c1c[nH+]ccc1CO	mol3720	OCc1ccncc1O