pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.8899999	OCHEM	0	-1	C[C@@H]1CCCC[C@@H]1C(=O)O	C[C@@H]1CCCC[C@@H]1C(=O)[O-]	mol32563	CC1CCCCC1C(=O)O
4.74	OCHEM	0	-1	C[C@@H]1CCCC[C@@H]1C(=O)O	C[C@@H]1CCCC[C@@H]1C(=O)[O-]	mol32563	CC1CCCCC1C(=O)O
5.73999977111816	QSARToolbox	0	-1	C[C@@H]1CCCC[C@@H]1C(=O)O	C[C@@H]1CCCC[C@@H]1C(=O)[O-]	mol32563	CC1CCCCC1C(=O)O
5.03999996185303	QSARToolbox	0	-1	C[C@@H]1CCCC[C@@H]1C(=O)O	C[C@@H]1CCCC[C@@H]1C(=O)[O-]	mol32563	CC1CCCCC1C(=O)O