econazole

Ligand id: 2446

Name: econazole

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 27.05
Molecular weight 380.02
XLogP 4.82
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1982))
IUPAC Name
1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
International Nonproprietary Names
INN number INN
3189 econazole
Synonyms
R-14827 | Spectazole®
Database Links
BindingDB Ligand 50134038
CAS Registry No. 27220-47-9
ChEBI CHEBI:4754
ChEMBL Ligand CHEMBL808
DrugBank Ligand DB01127
PubChem CID 3198
Search Google for chemical match using the InChIKey LEZWWPYKPKIXLL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LEZWWPYKPKIXLL
Search PubMed clinical trials econazole
Search PubMed titles econazole
Search PubMed titles/abstracts econazole
Search UniChem for chemical match using the InChIKey LEZWWPYKPKIXLL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LEZWWPYKPKIXLL
Wikipedia Econazole
Comments
Econazole topical is an antifungal agent. The preparation of econazole specified by the INN document is a racemic mixture of an (R)- and an (S)- isomer. The structure shown here does not specify stereochemistry and represents the mixture.
Marketed formulations may contain econazole nitrate (PubChem CID 68589).