Molecule ID: mol35921

SMILES: O=[N+]([O-])c1ccc(N2CCNCCNCCNCC2)c([N+](=O)[O-])c1

InChI: InChI=1S/C14H22N6O4/c21-19(22)12-1-2-13(14(11-12)20(23)24)18-9-7-16-5-3-15-4-6-17-8-10-18/h1-2,11,15-17H,3-10H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization