SNS-314

Ligand id: 9397

Name: SNS-314

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 148.31
Molecular weight 430.04
XLogP 3.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(3-chlorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl]urea
Synonyms
compound 21 [PMID: 18678489] | SNS314
Database Links
BindingDB Ligand 26326
PubChem CID 24995524
RCSB PDB Ligand AK2
Search Google for chemical match using the InChIKey FAYAUAZLLLJJGH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone FAYAUAZLLLJJGH
Search UniChem for chemical match using the InChIKey FAYAUAZLLLJJGH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone FAYAUAZLLLJJGH
Comments
SNS-314 is an inhibitor of Aurora kinases A and B [1]. CHEMBL482767 represents an alternative tautomer of the compound.