pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.95000004768372	QSARToolbox	2	1	CC(=[OH+])Nc1ccccc1C(=NCCC[NH+](C)C)c1ccccc1C,CC(=O)Nc1ccccc1C(=[NH+]CCC[NH+](C)C)c1ccccc1C	CC(=O)Nc1ccccc1C(=[NH+]CCCN(C)C)c1ccccc1C,CC(=O)Nc1ccccc1C(=NCCC[NH+](C)C)c1ccccc1C	mol36239	CC(=O)Nc1ccccc1C(=NCCCN(C)C)c1ccccc1C