pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.31	Datawarrior	0	-1	O=C(OCc1ccccc1)c1ccc(O)cc1	O=C(OCc1ccccc1)c1ccc([O-])cc1	mol15140	O=C(OCc1ccccc1)c1ccc(O)cc1
8.3100004	OCHEM	0	-1	O=C(OCc1ccccc1)c1ccc(O)cc1	O=C(OCc1ccccc1)c1ccc([O-])cc1	mol15140	O=C(OCc1ccccc1)c1ccc(O)cc1
8.41	AttenGpKa training set	0	-1	O=C(OCc1ccccc1)c1ccc(O)cc1	O=C(OCc1ccccc1)c1ccc([O-])cc1	mol15140	O=C(OCc1ccccc1)c1ccc(O)cc1