[125I]APNEA

Ligand id: 462

Name: [125I]APNEA    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 6
Topological polar surface area 151.57
Molecular weight 386.17
XLogP 0.18
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Synonyms
[3H]N6-2-(4-aminophenyl)ethyladenosine
Database Links
ChEMBL Ligand CHEMBL326958
PubChem CID 4397
Search Google for chemical match using the InChIKey XTPOZVLRZZIEBW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XTPOZVLRZZIEBW