Molecule ID: mol31945

SMILES: O=S(=O)(Nc1ccc(CCOCCCSCCNCCc2ccc(O)c3nc(O)sc23)cc1)c1ccccc1

InChI: InChI=1S/C28H33N3O5S3/c32-25-12-9-22(27-26(25)30-28(33)38-27)13-15-29-16-20-37-19-4-17-36-18-14-21-7-10-23(11-8-21)31-39(34,35)24-5-2-1-3-6-24/h1-3,5-12,29,31-32H,4,13-20H2,(H,30,33)

Experimental Macro pKa Values

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