pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.36	Baltruschat ChEMBL	1	0	Nc1ccc([NH3+])c([N+](=O)[O-])c1,Nc1ccc([NH3+])cc1[N+](=O)[O-]	Nc1ccc(N)c([N+](=O)[O-])c1	mol17649	Nc1ccc(N)c([N+](=O)[O-])c1
2.36999988555908	QSARToolbox	1	0	Nc1ccc([NH3+])c([N+](=O)[O-])c1,Nc1ccc([NH3+])cc1[N+](=O)[O-]	Nc1ccc(N)c([N+](=O)[O-])c1	mol17649	Nc1ccc(N)c([N+](=O)[O-])c1