pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.48	AttenGpKa training set	0	-1	COC(=O)c1ccc([N+](=O)[O-])[nH]1	COC(=O)c1ccc([N+](=O)[O-])[n-]1	mol25419	COC(=O)c1ccc([N+](=O)[O-])[nH]1