zopolrestat   Click here for help

GtoPdb Ligand ID: 7419

Synonyms: CP-73850
PDB Ligand
Compound class: Synthetic organic
Comment: Zopolrestat is an experimental aldose reductase inhibitor.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 113.32
Molecular weight 419.06
XLogP 3.38
No. Lipinski's rules broken 0
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Canonical SMILES OC(=O)Cc1nn(Cc2nc3c(s2)ccc(c3)C(F)(F)F)c(=O)c2c1cccc2
Isomeric SMILES OC(=O)Cc1nn(Cc2nc3c(s2)ccc(c3)C(F)(F)F)c(=O)c2c1cccc2
InChI InChI=1S/C19H12F3N3O3S/c20-19(21,22)10-5-6-15-14(7-10)23-16(29-15)9-25-18(28)12-4-2-1-3-11(12)13(24-25)8-17(26)27/h1-7H,8-9H2,(H,26,27)
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Summary of Clinical Use Click here for help
This compound is being invesigated for treatment of diabetic complications including neuropathy and retinopathy.
Mechanism Of Action and Pharmacodynamic Effects Click here for help
Aldose reductase inhibitors decrease the diabetes-associated accumulation of sorbitol in insulin insensitive tissues (such as lense cells, peripheral nerves and the renal glomerulus) which causes damage in these tissues and which leads to diabetic retinopathy, neuropathy and kidney damage [1].