Molecule ID: mol11142

SMILES: CCc1ccc(C=NO)[n+](C)c1

InChI: InChI=1S/C9H12N2O/c1-3-8-4-5-9(6-10-12)11(2)7-8/h4-7H,3H2,1-2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization