GSK5182

Ligand id: 8908

Name: GSK5182

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 52.93
Molecular weight 417.23
XLogP 7.54
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[(Z)-1-[4-(2-dimethylaminoethoxy)phenyl]-5-hydroxy-2-phenylpent-1-enyl]phenol
Synonyms
GSK 5182 | GSK-5182
Database Links
BindingDB Ligand 22435
ChEMBL Ligand CHEMBL201013
PubChem CID 6852176
RCSB PDB Ligand TXF
Search Google for chemical match using the InChIKey ZVSFNBNLNLXEFQ-RQZHXJHFSA-N
Search Google for chemicals with the same backbone ZVSFNBNLNLXEFQ
Search UniChem for chemical match using the InChIKey ZVSFNBNLNLXEFQ-RQZHXJHFSA-N
Search UniChem for chemicals with the same backbone ZVSFNBNLNLXEFQ
SynPHARM 83094 (in complex with Estrogen-related receptor-γ)
Comments
GSK5182 is an analogue of tamoxifen. It binds the ligand binding domain of the estrogen related receptor γ (ERRγ), acting as an inverse agonist [2].