Molecule ID: mol32001

SMILES: CN(CCCNCCc1ccc(O)c2nc(O)sc12)S(=O)(=O)CCOCCc1ccccc1

InChI: InChI=1S/C23H31N3O5S2/c1-26(33(29,30)17-16-31-15-11-18-6-3-2-4-7-18)14-5-12-24-13-10-19-8-9-20(27)21-22(19)32-23(28)25-21/h2-4,6-9,24,27H,5,10-17H2,1H3,(H,25,28)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.00 OCHEM 1 » 0
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Charge States and Microspecies Visualization