pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.15	Datawarrior	0	-1	COc1cccc2c1-c1c(O)cccc1-2	COc1cccc2c1-c1c([O-])cccc1-2	mol15799	COc1cccc2c1-c1c(O)cccc1-2
9.1499996	OCHEM	0	-1	COc1cccc2c1-c1c(O)cccc1-2	COc1cccc2c1-c1c([O-])cccc1-2	mol15799	COc1cccc2c1-c1c(O)cccc1-2
9.14999961853027	QSARToolbox	0	-1	COc1cccc2c1-c1c(O)cccc1-2	COc1cccc2c1-c1c([O-])cccc1-2	mol15799	COc1cccc2c1-c1c(O)cccc1-2