Molecule ID: mol10936

SMILES: O=C(O)c1ccc2nccnc2c1

InChI: InChI=1S/C9H6N2O2/c12-9(13)6-1-2-7-8(5-6)11-4-3-10-7/h1-5H,(H,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization