pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.29	AttenGpKa training set	0	-1	CC(=O)Nc1ccc(C(=O)Nn2cnnc2)cc1	CC(=O)Nc1ccc(C(=O)[N-]n2cnnc2)cc1	mol29650	CC(=O)Nc1ccc(C(=O)Nn2cnnc2)cc1