Molecule ID: mol10970

SMILES: CCOC(=O)c1nc2cnc[nH]c-2nc1=O

InChI: InChI=1S/C9H8N4O3/c1-2-16-9(15)6-8(14)13-7-5(12-6)3-10-4-11-7/h3-4H,2H2,1H3,(H,10,11,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization