Molecule ID: mol25574

SMILES: Cc1ccnn1-c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1

InChI: InChI=1S/C10H8N4O4/c1-7-4-5-11-12(7)8-2-3-9(13(15)16)10(6-8)14(17)18/h2-6H,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
-0.13 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization