pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.75	AttenGpKa training set	-1	-2	O=C([O-])[C@H]1CCCC[C@H]1C(=O)NO	O=C([O-])[C@H]1CCCC[C@H]1C(=O)N[O-],O=C([O-])[C@H]1CCCC[C@H]1C(=O)[N-]O	mol31430	O=C(O)[C@H]1CCCC[C@H]1C(=O)NO
