Molecule ID: mol28536

SMILES: C=CCNC(=O)NS(=O)(=O)c1ccc(Cl)cc1

InChI: InChI=1S/C10H11ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h2-6H,1,7H2,(H2,12,13,14)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization