Molecule ID: mol25264

SMILES: O=C(O)n1cccn1

InChI: InChI=1S/C4H4N2O2/c7-4(8)6-3-1-2-5-6/h1-3H,(H,7,8)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization