CX-4945

Ligand id: 8126

Name: CX-4945

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 75.11
Molecular weight 349.06
XLogP 3.98
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-[(3-chlorophenyl)amino]pyrido[4,3-c]quinoline-8-carboxylic acid
International Nonproprietary Names
INN number INN
9213 silmitasertib
Synonyms
CX 4945 | CX4945
Database Links
CAS Registry No. 1009820-21-6
ChEMBL Ligand CHEMBL1230165
PubChem CID 24748573
RCSB PDB Ligand 3NG
Search Google for chemical match using the InChIKey MUOKSQABCJCOPU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MUOKSQABCJCOPU
Search PubMed clinical trials silmitasertib
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Search UniChem for chemical match using the InChIKey MUOKSQABCJCOPU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MUOKSQABCJCOPU
SynPHARM 81423 (in complex with casein kinase 2, alpha 1 polypeptide subunit)
Comments
CX-4945 is a a potent and selective inhibitor of CK2 (casein kinase 2) [2-3]. CX-4945 is described in the same article as CX-5011 and CX-5279 [1]