avacopan

Ligand id: 9450

Name: avacopan

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 61.44
Molecular weight 581.27
XLogP 8.86
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
International Nonproprietary Names
INN number INN
10211 avacopan
Synonyms
CCX-168 | CCX168
Database Links
PubChem CID 49841217
Search Google for chemical match using the InChIKey PUKBOVABABRILL-YZNIXAGQSA-N
Search Google for chemicals with the same backbone PUKBOVABABRILL
Search PubMed clinical trials avacopan
Search PubMed titles avacopan
Search PubMed titles/abstracts avacopan
Search UniChem for chemical match using the InChIKey PUKBOVABABRILL-YZNIXAGQSA-N
Search UniChem for chemicals with the same backbone PUKBOVABABRILL
Comments
Small molecule antagonist of human C5a1 receptor; in Phase III clinical trials for pancreatic cancer treament.