General
Preferred name
PELUBIPROFEN
Synonyms
CS-670 ()
RS-2131 ()
P&D ID
PD058650
CAS
69956-77-0
Tags
available
drug
Drug indication
Back pain
Drug Status
investigational
approved
Max Phase
Phase 3
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Pelubiprofen is a nonsteroidal anti-inflammatory type compound . Structurally it is an aryl propionic acid derivative, like . The INN-defined agent is a racemic mixture of enantiomers. We show the structure without specified stereochemistry to represent the mixture. Pelubiprofen is described as a prodrug of 2-arylpropionic acid with modest selectivity for COX2 . (GtoPdb)
Compound Sets
6
ChEMBL Drugs
CHEMBL69308
DrugBank
DB12150
DrugMAP
DM8DQV9
DrugMAP Approved Drugs
DM8DQV9
Guide to Pharmacology
9876
MedChem Express Bioactive Compound Library
HY-12383
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
258.13
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
2
Aromatic Ring Count
1
cLogP
3.4
TPSA
54.37
Fraction CSP3
0.38
Chiral centers
1.0
Largest ring
6.0
QED
0.85
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Immunology/Inflammation
Target
COX
Source data