mexiletine   Click here for help

GtoPdb Ligand ID: 2629

Synonyms: Mexitil®
Approved drug
mexiletine is an approved drug (FDA (1985))
Compound class: Synthetic organic
Comment: Approved drug mexiletine is a racemic mixture of two enantiomers. The structure shown here does not specify stereochemistry and represents the mixture.
Marketed formulations may contain mexiletine hydrochloride (PubChem CID 21467).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 35.25
Molecular weight 179.13
XLogP 2.07
No. Lipinski's rules broken 0
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Canonical SMILES CC(COc1c(C)cccc1C)N
Isomeric SMILES CC(COc1c(C)cccc1C)N
InChI InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1985))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
3262 mexiletine
Synonyms Click here for help
Database Links Click here for help
BindingDB Ligand 50117271
CAS Registry No. 31828-71-4 (source: Scifinder)
ChEBI CHEBI:115958
DrugBank Ligand DB00379
DrugCentral Ligand 1794
GtoPdb PubChem SID 135650603
PubChem CID 4178
Search Google for chemical match using the InChIKey VLPIATFUUWWMKC-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey VLPIATFUUWWMKC-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey VLPIATFUUWWMKC-UHFFFAOYSA-N
Wikipedia Mexiletine