pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.9	AttenGpKa training set	1	0	C[C@H](COc1ccccc1)N[NH3+],C[C@H](COc1ccccc1)[NH2+]N	C[C@H](COc1ccccc1)NN	mol29528	CC(COc1ccccc1)NN