GSK2194069

Ligand id: 8605

Name: GSK2194069

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 65.79
Molecular weight 428.18
XLogP 4.66
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[4-(1-benzofuran-5-yl)phenyl]-3-[[(3S)-1-(cyclopropanecarbonyl)pyrrolidin-3-yl]methyl]-1H-1,2,4-triazol-5-one
Synonyms
GSK 2194069 | GSK-2194069
Database Links
CAS Registry No. 1332331-08-4 (source: PubChem)
PubChem CID 67376285
RCSB PDB Ligand 2W4
Search Google for chemical match using the InChIKey AQTPWCUIYUOEMG-INIZCTEOSA-N
Search Google for chemicals with the same backbone AQTPWCUIYUOEMG
Search UniChem for chemical match using the InChIKey AQTPWCUIYUOEMG-INIZCTEOSA-N
Search UniChem for chemicals with the same backbone AQTPWCUIYUOEMG
SynPHARM 82454 (in complex with fatty acid synthase)
Comments
GSK2194069 is reported to selectively and potently inhibit fatty acid synthase (FASN) [1].