icotinib

Ligand id: 7641

Name: icotinib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 74.73
Molecular weight 391.15
XLogP 2.93
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
N-(3-ethynylphenyl)-7H,8H,10H,11H,13H,14H-1,4,7,10-tetraoxacyclododeca[2,3-g]quinazolin-4-amine
Synonyms
BPI-2009H | Conmana®
Database Links
CAS Registry No. 610798-31-7 (source: SciFinder)
ChEMBL Ligand CHEMBL2087361
GtoPdb PubChem SID 223365976
PubChem CID 22024915
Search Google for chemical match using the InChIKey QQLKULDARVNMAL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QQLKULDARVNMAL
Search UniChem for chemical match using the InChIKey QQLKULDARVNMAL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QQLKULDARVNMAL
Wikipedia Icotinib
Comments
Icotinib is a selective, orally available epidermal growth factor receptor tyrosine kinase inhibitor [1-3]. Click here to view icotinib trials registered with ClinicalTrials.gov.