pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.1999998092651	QSARToolbox	0	-1	COc1ccc(O[C@@](O)(CBr)c2ccccc2)cc1	COc1ccc(O[C@@]([O-])(CBr)c2ccccc2)cc1	mol34180	COc1ccc(OC(O)(CBr)c2ccccc2)cc1
11.2299995422363	QSARToolbox	0	-1	COc1ccc(O[C@@](O)(CBr)c2ccccc2)cc1	COc1ccc(O[C@@]([O-])(CBr)c2ccccc2)cc1	mol34180	COc1ccc(OC(O)(CBr)c2ccccc2)cc1