AG 1024   

GtoPdb Ligand ID: 5912

Synonyms: AG-1024 | AG1024 | tyrphostin AG 1024
Compound class: Synthetic organic
Comment: AG 1024 is a selective inhibitor of IGF1R (Insulin-like growth factor I receptor) and inhibits insulin-stimulated cellular proliferation [3].
2D Structure
Click here for structure editor
Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 67.81
Molecular weight 304.02
XLogP 3.66
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES N#CC(=Cc1cc(Br)c(c(c1)C(C)(C)C)O)C#N
Isomeric SMILES N#CC(=Cc1cc(Br)c(c(c1)C(C)(C)C)O)C#N
InChI InChI=1S/C14H13BrN2O/c1-14(2,3)11-5-9(4-10(7-16)8-17)6-12(15)13(11)18/h4-6,18H,1-3H3
InChI Key ABBADGFSRBWENF-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
IUPAC Name
2-[(3-bromo-5-tert-butyl-4-hydroxyphenyl)methylidene]propanedinitrile
Synonyms
AG-1024 | AG1024 | tyrphostin AG 1024
Comments
AG 1024 is a selective inhibitor of IGF1R (Insulin-like growth factor I receptor) and inhibits insulin-stimulated cellular proliferation [3].
Database Links
CAS Registry No. 65678-07-1
ChEMBL Ligand CHEMBL2218926
GtoPdb PubChem SID 178102535
PubChem CID 2044
Search Google for chemical match using the InChIKey ABBADGFSRBWENF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ABBADGFSRBWENF
Search UniChem for chemical match using the InChIKey ABBADGFSRBWENF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ABBADGFSRBWENF