Ligand Id: 4159
Ligand name clomiphene

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 9
Topological polar surface area 12.47
Molecular weight 405.19
XLogP 9.85
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
Approved drug? Yes (source: Drugbank)
IUPAC Name
{2-[4-(2-chloro-1,2-diphenylethenyl)phenoxy]ethyl}diethylamine
Synonyms
clomifene
Database Links
CAS Registry No. 911-45-5 (source: Scifinder)
ChEBI CHEBI:3752
DrugBank Ligand DB00882
Search on ChemSpider GKIRPKYJQBWNGO-UHFFFAOYSA-N
Wikipedia Clomifene
ZINC ZINC01530601, ZINC12402836

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

Comments
The approved drug clomiphene is a mixture of the two geometric isomers E and Z clomiphene (also known as enclomifene and zuclomifene)