filgotinib

Ligand id: 7913

Name: filgotinib

Structure and Physico-chemical Properties

2D Structure
Click here for structure editor
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 105.05
Molecular weight 425.15
XLogP 1.99
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[5-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
International Nonproprietary Names
INN number INN
9720 filgotinib
Synonyms
GLPG-0634 | GLPG0634
Comments
Filgotinib is a selective and orally acive JAK1 inhibitor [3]. It is being developed in a collaboration between Gilead Sciences and Galapagos for the treatment of inflammatory indications including psoriatic arthritis, ankylosing spondylitis, Crohn's disease, ulcerative colitis and rheumatoid arthritis.
Database Links
CAS Registry No. 1206161-97-8
ChEMBL Ligand CHEMBL3301607
GtoPdb PubChem SID 249565596
PubChem CID 49831257
RCSB PDB Ligand 2HB
Search Google for chemical match using the InChIKey RIJLVEAXPNLDTC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RIJLVEAXPNLDTC
Search PubMed clinical trials filgotinib
Search PubMed titles filgotinib
Search PubMed titles/abstracts filgotinib
Search UniChem for chemical match using the InChIKey RIJLVEAXPNLDTC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RIJLVEAXPNLDTC
SynPHARM 80797 (in complex with Janus kinase 2)
85292 (in complex with Janus kinase 2)
Wikipedia Filgotinib