pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.7	AttenGpKa training set	0	-1	CO/N=C1/C=C/C(=N\O)C=C1Br	CO/N=C1/C=C/C(=N\[O-])C=C1Br	mol31630	CO/N=C1/C=C/C(=N\O)C=C1Br