pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.12	Hunt	1	0	CC[C@@H](C)Nc1nc(C)cc(C)[nH+]1,CC[C@@H](C)[NH2+]c1nc(C)cc(C)n1	CC[C@@H](C)Nc1nc(C)cc(C)n1	mol1612	CC[C@@H](C)Nc1nc(C)cc(C)n1