Molecule ID: mol32019

SMILES: O=[N+]([O-])c1ccc(CCOCCCSCCNCCc2ccc(O)c3nc(O)sc23)cc1

InChI: InChI=1S/C22H27N3O5S2/c26-19-7-4-17(21-20(19)24-22(27)32-21)8-10-23-11-15-31-14-1-12-30-13-9-16-2-5-18(6-3-16)25(28)29/h2-7,23,26H,1,8-15H2,(H,24,27)

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