[125I]BE-2254

Ligand id: 500

Name: [125I]BE-2254    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 49.33
Molecular weight 421.05
XLogP 5.38
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[[2-(4-hydroxy-3-iodophenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one
Synonyms
2-[[2-(4-hydroxy-3-iodanylphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one | 2-{p-(4-hydroxy-3-[125I]iodophenyl)ethylaminomethyl}-tetralone | HEAT
Database Links
GtoPdb PubChem SID 135651103
PubChem CID 449744
Search Google for chemical match using the InChIKey DUOOAUBZMQZYLO-STTHPYEQSA-N
Search Google for chemicals with the same backbone DUOOAUBZMQZYLO
Search UniChem for chemical match using the InChIKey DUOOAUBZMQZYLO-STTHPYEQSA-N
Search UniChem for chemicals with the same backbone DUOOAUBZMQZYLO