Ligand id: 1891

Name: [3H]PGD2    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 94.83
Molecular weight 352.22
XLogP 2.9
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Compound class Metabolite or derivative
(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-oxocyclopentyl]hept-5-enoic acid
[3H]11-dehydroprostaglandin F2-alpha
[3H]prostaglandin D2
Database Links
ChEMBL Ligand CHEMBL1235252
PubChem CID 448457
Search Google for chemical match using the InChIKey BHMBVRSPMRCCGG-OUTUXVNYSA-N
Search Google for chemicals with the same backbone BHMBVRSPMRCCGG