pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.14999961853027	QSARToolbox	0	-1	COc1ccc(C[C@H](NC(=O)C[NH3+])C(=O)[O-])cc1	COc1ccc(C[C@H](NC(=O)CN)C(=O)[O-])cc1	mol37439	COc1ccc(C[C@H](NC(=O)CN)C(=O)O)cc1