GW7647

Ligand Id: 2674
Ligand name GW7647

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 14
Topological polar surface area 94.94
Molecular weight 502.32
XLogP 8.29
No. Lipinski's rules broken 2

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
2-[4-[2-(4-cyclohexylbutyl-(cyclohexylcarbamoyl)amino)ethyl]phenyl]sulfanyl-2-methylpropanoic acid
Database Links
BindingDB Ligand 50099491
ChEBI CHEBI:125497
ChEMBL Ligand 125497
NURSA Ligand li22
PubChem CID 3392731
Search Google for chemical match using the InChIKey PKNYXWMTHFMHKD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PKNYXWMTHFMHKD
ZINC ZINC03995991