pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.55	Datawarrior	0	-1	Cc1coc(C)c1C(=O)O	Cc1coc(C)c1C(=O)[O-]	mol12941	Cc1coc(C)c1C(=O)O
4.5500002	OCHEM	0	-1	Cc1coc(C)c1C(=O)O	Cc1coc(C)c1C(=O)[O-]	mol12941	Cc1coc(C)c1C(=O)O
4.55000019073486	QSARToolbox	0	-1	Cc1coc(C)c1C(=O)O	Cc1coc(C)c1C(=O)[O-]	mol12941	Cc1coc(C)c1C(=O)O
