Molecule ID: mol21048

SMILES: CCCCCNC(=O)NS(=O)(=O)c1cc(Cl)ccc1OC

InChI: InChI=1S/C13H19ClN2O4S/c1-3-4-5-8-15-13(17)16-21(18,19)12-9-10(14)6-7-11(12)20-2/h6-7,9H,3-5,8H2,1-2H3,(H2,15,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.46 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization