pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.8	Baltruschat ChEMBL	1	0	Nc1ccc([NH+]2CCc3ccccc3C2)nc1,[NH3+]c1ccc(N2CCc3ccccc3C2)nc1,Nc1ccc(N2CCc3ccccc3C2)[nH+]c1	Nc1ccc(N2CCc3ccccc3C2)nc1	mol18442	Nc1ccc(N2CCc3ccccc3C2)nc1