pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.3	IUPAC digitized pKa	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1
1.31	Datawarrior	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1
1.3099999	OCHEM	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1
-2.97	Baltruschat ChEMBL	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1
1.29999995231628	QSARToolbox	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1
-2.5	AttenGpKa training set	1	0	c1c[nH+]oc1	c1cnoc1	mol3935	c1cnoc1