pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.58	AttenGpKa training set	0	-1	O=C(O)/C=C\[N+](=O)[O-]	O=C([O-])/C=C\[N+](=O)[O-]	mol22669	O=C(O)/C=C\[N+](=O)[O-]
