pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.85000038146973	QSARToolbox	0	-1	CC(=O)/C(=N/O)c1ccccc1	CC(=O)/C(=N/[O-])c1ccccc1	mol31559	CC(=O)/C(=N/O)c1ccccc1
8.85	AttenGpKa training set	0	-1	CC(=O)/C(=N/O)c1ccccc1	CC(=O)/C(=N/[O-])c1ccccc1	mol31559	CC(=O)/C(=N/O)c1ccccc1