Molecule ID: mol7103

SMILES: Cc1ncc([N+](=O)[O-])c(N)n1

InChI: InChI=1S/C5H6N4O2/c1-3-7-2-4(9(10)11)5(6)8-3/h2H,1H3,(H2,6,7,8)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.67 IUPAC digitized pKa 1 » 0
2.67 OCHEM 1 » 0
2.67 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization