JNK inhibitor IX

Ligand id: 5996

Name: JNK inhibitor IX

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 81.13
Molecular weight 332.1
XLogP 6.15
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)naphthalene-1-carboxamide
Synonyms
AC1LG8KT | BAS 01816608 | TCS JNK 5a
Database Links
CAS Registry No. 312917-14-9
ChEMBL Ligand CHEMBL233001
PubChem CID 766949
Search Google for chemical match using the InChIKey WQGDQGAFSDMBLA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WQGDQGAFSDMBLA
Search UniChem for chemical match using the InChIKey WQGDQGAFSDMBLA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WQGDQGAFSDMBLA
Comments
Selective inhibitor of JNK2 and JNK3.