pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.5	Baltruschat ChEMBL	1	0	Cc1cc(N)[nH+]c(N2CCc3ccccc3C2)c1,Cc1cc([NH3+])nc(N2CCc3ccccc3C2)c1,Cc1cc(N)nc([NH+]2CCc3ccccc3C2)c1	Cc1cc(N)nc(N2CCc3ccccc3C2)c1	mol18453	Cc1cc(N)nc(N2CCc3ccccc3C2)c1