PGE1

Ligand id: 1882

Name: PGE1

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 13
Topological polar surface area 94.83
Molecular weight 354.24
XLogP 3.31
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Approved drug? Yes (source: FDA (1981))
IUPAC Name
7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid
International Nonproprietary Names
INN number INN
4425 alprostadil
Synonyms
Alprostadil® | MR-256 | prostaglandin E1
Database Links
BindingDB Ligand 50101853
CAS Registry No. 745-65-3
ChEBI CHEBI:15544
ChEMBL Ligand CHEMBL495
DrugBank Ligand DB00770
PubChem CID 5280723
RCSB PDB Ligand XPG
Search Google for chemical match using the InChIKey GMVPRGQOIOIIMI-DWKJAMRDSA-N
Search Google for chemicals with the same backbone GMVPRGQOIOIIMI
Search PubMed clinical trials alprostadil
Search PubMed titles alprostadil
Search PubMed titles/abstracts alprostadil
Search UniChem for chemical match using the InChIKey GMVPRGQOIOIIMI-DWKJAMRDSA-N
Search UniChem for chemicals with the same backbone GMVPRGQOIOIIMI
Wikipedia Prostaglandin_E1
Comments
PGE1 is an endogenous prostaglandin. Synthetic PGE1 is known as alprostadil. PGE1 activates prostanoid family GPCRs.