Molecule ID: mol4657

SMILES: COc1ccc2c[n+]([O-])cnc2c1

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

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
0.66 IUPAC digitized pKa 1 » 0
0.96 IUPAC digitized pKa 1 » 0
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Charge States and Microspecies Visualization