Molecule ID: mol31961

SMILES: O=S(=O)(CCCNCCc1ccc(O)c2nc(O)sc12)NCCOCCc1ccc(F)cc1

InChI: InChI=1S/C22H28FN3O5S2/c23-18-5-2-16(3-6-18)9-13-31-14-12-25-33(29,30)15-1-10-24-11-8-17-4-7-19(27)20-21(17)32-22(28)26-20/h2-7,24-25,27H,1,8-15H2,(H,26,28)

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