Molecule ID: mol7056

SMILES: CCOC(=O)c1cnc(O)nc1N

InChI: InChI=1S/C7H9N3O3/c1-2-13-6(11)4-3-9-7(12)10-5(4)8/h3H,2H2,1H3,(H3,8,9,10,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization