pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.88000011444092	QSARToolbox	1	0	Cn1cc[n+](CC(=O)NO)c1	Cn1cc[n+](CC(=O)N[O-])c1,Cn1cc[n+](CC(=O)[N-]O)c1	mol31410	Cn1cc[n+](CC(=O)NO)c1
7.88	AttenGpKa training set	1	0	Cn1cc[n+](CC(=O)NO)c1	Cn1cc[n+](CC(=O)N[O-])c1,Cn1cc[n+](CC(=O)[N-]O)c1	mol31410	Cn1cc[n+](CC(=O)NO)c1