pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.7	Baltruschat ChEMBL	1	0	Cc1cnc([NH+]2CCc3ccccc3C2)cc1N,Cc1cnc(N2CCc3ccccc3C2)cc1[NH3+],Cc1c[nH+]c(N2CCc3ccccc3C2)cc1N	Cc1cnc(N2CCc3ccccc3C2)cc1N	mol18460	Cc1cnc(N2CCc3ccccc3C2)cc1N