Molecule ID: mol4655

SMILES: COc1cccc2nc[n+]([O-])cc12

InChI: InChI=1S/C9H8N2O2/c1-13-9-4-2-3-8-7(9)5-11(12)6-10-8/h2-6H,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization