pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.02999973297119	QSARToolbox	2	1	O=C(C[n+]1cccc(C=NO)c1)C[n+]1cccc(C(=O)Nc2ccccc2)c1	O=C(C[n+]1cccc(C=N[O-])c1)C[n+]1cccc(C(=O)Nc2ccccc2)c1,O=C(C[n+]1cccc(C=NO)c1)C[n+]1cccc(C(=O)[N-]c2ccccc2)c1	mol37046	O=C(C[n+]1cccc(C=NO)c1)C[n+]1cccc(C(=O)Nc2ccccc2)c1