enprostil

Ligand id: 1918

Name: enprostil

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 93.06
Molecular weight 400.19
XLogP 3.82
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl 7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxy-4-(phenoxy)but-1-enyl]-5-oxocyclopentyl]hepta-4,5-dienoate
International Nonproprietary Names
INN number INN
5382 enprostil
Synonyms
gardrin | RS 84135-004 | RS-84135
Database Links
CAS Registry No. 73121-56-9 (source: Scifinder)
ChEMBL Ligand CHEMBL2104194
PubChem CID 5311225
Search Google for chemical match using the InChIKey PTOJVMZPWPAXER-VFJVYMGBSA-N
Search Google for chemicals with the same backbone PTOJVMZPWPAXER
Search PubMed clinical trials enprostil
Search PubMed titles enprostil
Search PubMed titles/abstracts enprostil
Search UniChem for chemical match using the InChIKey PTOJVMZPWPAXER-VFJVYMGBSA-N
Search UniChem for chemicals with the same backbone PTOJVMZPWPAXER
Wikipedia Enprostil
Comments
The INN-assigned compound enprostil is a racemic mixture of two enantiomers, the structure of one of which is shown here and is also represented in the PubChem link above. We have chosen to link to the PubChem entry with the highest number of same-structure matches. The other enantiomer is represented by CID 6435207.