WS-3

Ligand id: 2475

Name: WS-3

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 29.1
Molecular weight 211.19
XLogP 4.14
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-ethyl-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
Synonyms
WS 3
Database Links
CAS Registry No. 39711-79-0 (source: Scifinder)
ChEMBL Ligand CHEMBL3185043
PubChem CID 62907
Search Google for chemical match using the InChIKey VUNOFAIHSALQQH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VUNOFAIHSALQQH
Search UniChem for chemical match using the InChIKey VUNOFAIHSALQQH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VUNOFAIHSALQQH