[125I]SQ-29548

Ligand id: 1983

Name: [125I]SQ-29548    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 12
Topological polar surface area 99.69
Molecular weight 513.11
XLogP 4.78
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(5Z)-7-[(1S,2R,3R,4R)-3-{[({[4-(125I)iodophenyl]carbamoyl}amino)amino]methyl}-7-oxabicyclo[2.2.1]heptan-2-yl]hept-5-enoic acid
Database Links
PubChem CID 73755025
Search Google for chemical match using the InChIKey AMZRVJWBVXWSAC-BYMOSMHDSA-N
Search Google for chemicals with the same backbone AMZRVJWBVXWSAC
Search UniChem for chemical match using the InChIKey AMZRVJWBVXWSAC-BYMOSMHDSA-N
Search UniChem for chemicals with the same backbone AMZRVJWBVXWSAC