pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.6	Baltruschat ChEMBL	1	0	CC(=O)Nc1cc(-c2cccc([NH+]3CCN(C)CC3)n2)nc(-n2nc(C)cc2C)n1,CC(=O)Nc1cc(-c2cccc(N3CC[NH+](C)CC3)n2)nc(-n2nc(C)cc2C)n1	CC(=O)Nc1cc(-c2cccc(N3CCN(C)CC3)n2)nc(-n2nc(C)cc2C)n1	mol19837	CC(=O)Nc1cc(-c2cccc(N3CCN(C)CC3)n2)nc(-n2nc(C)cc2C)n1