Molecule ID: mol35932

SMILES: O=[N+]([O-])c1ccc(C(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1

InChI: InChI=1S/C19H11N5O10/c25-20(26)12-3-1-11(2-4-12)19(15-7-5-13(21(27)28)9-17(15)23(31)32)16-8-6-14(22(29)30)10-18(16)24(33)34/h1-10,19H

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.68 QSARToolbox 0 » -1
9.11 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization