pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.03	Datawarrior	0	-1	O=[N+]([O-])c1ccc(/C=N/O)cc1	O=[N+]([O-])c1ccc(/C=N/[O-])cc1	mol12622	O=[N+]([O-])c1ccc(/C=N/O)cc1
9.97000026702881	QSARToolbox	0	-1	O=[N+]([O-])c1ccc(/C=N/O)cc1	O=[N+]([O-])c1ccc(/C=N/[O-])cc1	mol12622	O=[N+]([O-])c1ccc(/C=N/O)cc1
10.0900001525879	QSARToolbox	0	-1	O=[N+]([O-])c1ccc(/C=N/O)cc1	O=[N+]([O-])c1ccc(/C=N/[O-])cc1	mol12622	O=[N+]([O-])c1ccc(/C=N/O)cc1
10.2799997329712	QSARToolbox	0	-1	O=[N+]([O-])c1ccc(/C=N/O)cc1	O=[N+]([O-])c1ccc(/C=N/[O-])cc1	mol12622	O=[N+]([O-])c1ccc(/C=N/O)cc1