pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.28	AttenGpKa training set	0	-1	COc1ccc(OC)c2c(=O)c3cc(O)ccc3oc12	COc1ccc(OC)c2c(=O)c3cc([O-])ccc3oc12	mol29723	COc1ccc(OC)c2c(=O)c3cc(O)ccc3oc12