pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.9	Novartis	1	0	Nc1nc(N2CCc3ccc(Br)cc32)cc[nH+]1,Nc1nccc([NH+]2CCc3ccc(Br)cc32)n1,Nc1nccc(N2CCc3ccc(Br)cc32)[nH+]1,[NH3+]c1nccc(N2CCc3ccc(Br)cc32)n1	Nc1nccc(N2CCc3ccc(Br)cc32)n1	mol2970	Nc1nccc(N2CCc3ccc(Br)cc32)n1