Molecule ID: mol35350

SMILES: Cc1cc(Cc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)cc(C)c1O

InChI: InChI=1S/C15H14N2O6/c1-8-3-10(4-9(2)14(8)18)5-11-6-12(16(20)21)7-13(15(11)19)17(22)23/h3-4,6-7,18-19H,5H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.64 QSARToolbox -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization