pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.6	AttenGpKa training set	0	-1	O=[N+]([O-])c1ccc(Nc2[nH]nnc2-c2ccccc2)cc1	O=[N+]([O-])c1ccc(Nc2[n-]nnc2-c2ccccc2)cc1	mol25601	O=[N+]([O-])c1ccc(Nc2[nH]nnc2-c2ccccc2)cc1