Ligand id: 6700

Name: prinaberel

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 66.49
Molecular weight 271.06
XLogP 2.99
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Compound class Synthetic organic
International Nonproprietary Names
INN number INN
8771 prinaberel
ERB 041
Database Links
CAS Registry No. 524684-52-4 (source: SciFinder)
ChEMBL Ligand CHEMBL450940
PubChem CID 67011843
RCSB PDB Ligand 41
Search Google for chemical match using the InChIKey MQIMZDXIAHJKQP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MQIMZDXIAHJKQP
Search PubMed clinical trials prinaberel
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Wikipedia Prinaberel
Prinaberel is an estrogen receptor beta (ERβ) agonist, with potential gynecological uses and antiinflammatory action [1-3].

The structure shown here matches that in the INN document for prinaberel, and as in the ChEMBL entry provided above. However, alternative tautomers are represented elsewhere including CID 5326893.