pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.86	Datawarrior	0	-1	CCOc1ccc(C)c(C(=O)O)c1	CCOc1ccc(C)c(C(=O)[O-])c1	mol11233	CCOc1ccc(C)c(C(=O)O)c1
3.8599999	OCHEM	0	-1	CCOc1ccc(C)c(C(=O)O)c1	CCOc1ccc(C)c(C(=O)[O-])c1	mol11233	CCOc1ccc(C)c(C(=O)O)c1
3.85999989509583	QSARToolbox	0	-1	CCOc1ccc(C)c(C(=O)O)c1	CCOc1ccc(C)c(C(=O)[O-])c1	mol11233	CCOc1ccc(C)c(C(=O)O)c1
