Molecule ID: mol28759

SMILES: CCCCNC(=O)NS(=O)(=O)c1ccc(Br)cc1

InChI: InChI=1S/C11H15BrN2O3S/c1-2-3-8-13-11(15)14-18(16,17)10-6-4-9(12)5-7-10/h4-7H,2-3,8H2,1H3,(H2,13,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization