pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.35	AttenGpKa training set	0	-1	CC(C)C(=[NH2+])N[O-],CC(C)C(=N)NO	CC(C)C(=[N-])NO,CC(C)C(=N)[N-]O,CC(C)C(=N)N[O-]	mol28004	CC(C)C(=N)NO