Molecule ID: mol10950

SMILES: O=C(O)c1cn(-c2ccccc2)nn1

InChI: InChI=1S/C9H7N3O2/c13-9(14)8-6-12(11-10-8)7-4-2-1-3-5-7/h1-6H,(H,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.88 IUPAC digitized pKa 0 » -1
2.88 OCHEM 0 » -1
2.88 OCHEM 0 » -1
2.88 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization