pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.84	Datawarrior	0	-1	COc1c(C)cccc1C(=O)O	COc1c(C)cccc1C(=O)[O-]	mol10875	COc1c(C)cccc1C(=O)O
3.8399999	OCHEM	0	-1	COc1c(C)cccc1C(=O)O	COc1c(C)cccc1C(=O)[O-]	mol10875	COc1c(C)cccc1C(=O)O
3.83999991416931	QSARToolbox	0	-1	COc1c(C)cccc1C(=O)O	COc1c(C)cccc1C(=O)[O-]	mol10875	COc1c(C)cccc1C(=O)O
