pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.6	AttenGpKa training set	1	0	CCc1cc[n+](C/C(=N/O)c2ccccc2)cc1	CCc1cc[n+](C/C(=N/[O-])c2ccccc2)cc1	mol31633	CCc1cc[n+](C/C(=N/O)c2ccccc2)cc1