pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.60000038146973	QSARToolbox	0	-1	N#Cc1ccc(NC(=N)N[N+](=O)[O-])cc1	N#Cc1ccc(NC(=[N-])N[N+](=O)[O-])cc1,N#Cc1ccc(NC(=N)[N-][N+](=O)[O-])cc1	mol28062	N#Cc1ccc(NC(=N)N[N+](=O)[O-])cc1
8.6	AttenGpKa training set	0	-1	N#Cc1ccc(NC(=N)N[N+](=O)[O-])cc1	N#Cc1ccc(NC(=[N-])N[N+](=O)[O-])cc1,N#Cc1ccc(NC(=N)[N-][N+](=O)[O-])cc1	mol28062	N#Cc1ccc(NC(=N)N[N+](=O)[O-])cc1