pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.18	Datawarrior	0	-1	CCOc1ccccc1C(=O)O	CCOc1ccccc1C(=O)[O-]	mol5606	CCOc1ccccc1C(=O)O
4.1799998	OCHEM	0	-1	CCOc1ccccc1C(=O)O	CCOc1ccccc1C(=O)[O-]	mol5606	CCOc1ccccc1C(=O)O
4.21	OCHEM	0	-1	CCOc1ccccc1C(=O)O	CCOc1ccccc1C(=O)[O-]	mol5606	CCOc1ccccc1C(=O)O
4.21000003814697	QSARToolbox	0	-1	CCOc1ccccc1C(=O)O	CCOc1ccccc1C(=O)[O-]	mol5606	CCOc1ccccc1C(=O)O
4.15999984741211	QSARToolbox	0	-1	CCOc1ccccc1C(=O)O	CCOc1ccccc1C(=O)[O-]	mol5606	CCOc1ccccc1C(=O)O