Zimelidine hydrochlorideProduct ingredient for Zimelidine
- Name
- Zimelidine hydrochloride
- Drug Entry
- Zimelidine
Zimelidine has been banned worldwide due to serious, sometimes fatal, cases of central and/or peripheral neuropathy known as Guillain-Barré syndrome and due to a peculiar hypersensitivity reaction involving many organs including skin exanthema, flu-like symptoms, arthralgias, and sometimes eosinophilia. Additionally, zimelidine was charged to cause an increase in suicidal ideation and/or attempts among depressive patients.
- Accession Number
- DBSALT002851
- Structure
Structure for Zimelidine hydrochloride (DBSALT002851)
- Synonyms
- Zimelidine HCl
- UNII
- 7GLK27586K
- CAS Number
- 60525-15-7
- Weight
- Average: 353.69
Monoisotopic: 352.034189 - Chemical Formula
- C16H18BrClN2
- InChI Key
- GELMUARXROJGSO-LFMIJCLESA-N
- InChI
- InChI=1S/C16H17BrN2.ClH/c1-19(2)11-9-16(14-4-3-10-18-12-14)13-5-7-15(17)8-6-13;/h3-10,12H,11H2,1-2H3;1H/b16-9-;
- IUPAC Name
- [(2Z)-3-(4-bromophenyl)-3-(pyridin-3-yl)prop-2-en-1-yl]dimethylamine hydrochloride
- SMILES
- Cl.CN(C)C\C=C(\C1=CC=C(Br)C=C1)C1=CC=CN=C1
- External Links
- ChemSpider
- 11328021
- ChEMBL
- CHEMBL1257115
- Predicted Properties
Property Value Source Water Solubility 0.0239 mg/mL ALOGPS logP 3.39 ALOGPS logP 3.51 Chemaxon logS -4.1 ALOGPS pKa (Strongest Basic) 8.62 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 16.13 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 93.94 m3·mol-1 Chemaxon Polarizability 30.92 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon