Akt inhibitor IV

Ligand id: 5919

Name: Akt inhibitor IV

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 53.18
Molecular weight 487.2
XLogP 10.11
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-(1,3-benzothiazol-2-yl)-3-ethyl-2-[(E)-2-[methyl(phenyl)amino]ethenyl]-1-phenyl-1H-1,3-benzodiazol-3-ium
Synonyms
GNF-PF-254
Database Links
CAS Registry No. 749244-28-8
ChEMBL Ligand CHEMBL1186409
PubChem CID 2326992
Search Google for chemical match using the InChIKey OTHITMYLBRCVIT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone OTHITMYLBRCVIT
Comments
This is compound 5233705 in [4] (this is its ChemBridge reference). It was originally reported to be an AKT (protein kinase B) inhibitor [5]. However, the primary molecular target(s) of this compound have not been clearly identified, and its action may involve activation of the PDK1 kinase upstream of AKT, modulation of mTORC2 or targets outside of the PI3-kinase/AKT pathway [2].
PI3-kinase/AKT pathway inhibitors are under investigation as anticancer and antiviral agents.