Molecule ID: mol1659

SMILES: N#Cc1cc(N)cc([N+](=O)[O-])c1

InChI: InChI=1S/C7H5N3O2/c8-4-5-1-6(9)3-7(2-5)10(11)12/h1-3H,9H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
0.45 Hunt 1 » 0
0.46 OCHEM 1 » 0
0.46 OCHEM 1 » 0
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Charge States and Microspecies Visualization