pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.0	QSARToolbox	1	0	C/C(=N\O)c1cc[n+](C)cc1	C/C(=N\[O-])c1cc[n+](C)cc1	mol31545	C/C(=N\O)c1cc[n+](C)cc1
9.5	QSARToolbox	1	0	C/C(=N\O)c1cc[n+](C)cc1	C/C(=N\[O-])c1cc[n+](C)cc1	mol31545	C/C(=N\O)c1cc[n+](C)cc1
9.2	AttenGpKa training set	1	0	C/C(=N\O)c1cc[n+](C)cc1	C/C(=N\[O-])c1cc[n+](C)cc1	mol31545	C/C(=N\O)c1cc[n+](C)cc1