pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.79	Datawarrior	0	-1	COc1cc(CO)ccc1O	COc1cc(CO)ccc1[O-]	mol14127	COc1cc(CO)ccc1O
10.3999996185303	QSARToolbox	0	-1	COc1cc(CO)ccc1O	COc1cc(CO)ccc1[O-]	mol14127	COc1cc(CO)ccc1O
10.4499998092651	QSARToolbox	0	-1	COc1cc(CO)ccc1O	COc1cc(CO)ccc1[O-]	mol14127	COc1cc(CO)ccc1O
9.84000015258789	QSARToolbox	0	-1	COc1cc(CO)ccc1O	COc1cc(CO)ccc1[O-]	mol14127	COc1cc(CO)ccc1O
10.0799999237061	QSARToolbox	0	-1	COc1cc(CO)ccc1O	COc1cc(CO)ccc1[O-]	mol14127	COc1cc(CO)ccc1O
