pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.6000003814697	QSARToolbox	0	-1	CC1(C)CCC[C@H](S(C)(=O)=O)C1=O	CC1(C)CCC[C-](S(C)(=O)=O)C1=O	mol34148	CC1(C)CCCC(S(C)(=O)=O)C1=O
11.6199998855591	QSARToolbox	0	-1	CC1(C)CCC[C@H](S(C)(=O)=O)C1=O	CC1(C)CCC[C-](S(C)(=O)=O)C1=O	mol34148	CC1(C)CCCC(S(C)(=O)=O)C1=O