Molecule ID: mol28582

SMILES: CCCNC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1

InChI: InChI=1S/C10H13N3O5S/c1-2-7-11-10(14)12-19(17,18)9-5-3-8(4-6-9)13(15)16/h3-6H,2,7H2,1H3,(H2,11,12,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization