Molecule ID: mol10699

SMILES: CCCCCc1n[nH]c(=O)[nH]c1=O

InChI: InChI=1S/C8H13N3O2/c1-2-3-4-5-6-7(12)9-8(13)11-10-6/h2-5H2,1H3,(H2,9,11,12,13)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization