pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.63000011444092	QSARToolbox	1	0	O=C1N[C@H](Cc2c[nH+]c[nH]2)C(=O)N[C@@H]1Cc1cnc[nH]1	O=C1N[C@H](Cc2cnc[nH]2)C(=O)N[C@@H]1Cc1cnc[nH]1	mol37798	O=C1N[C@H](Cc2cnc[nH]2)C(=O)N[C@@H]1Cc1cnc[nH]1