[3H]citalopram

Ligand id: 4621

Name: [3H]citalopram    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 36.26
Molecular weight 324.16
XLogP 3.96
No. Lipinski's rules broken 0

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile
Synonyms
[3H]-citalopram
Database Links
ChEMBL Ligand CHEMBL549
GtoPdb PubChem SID 178101339
PubChem CID 2771
Search Google for chemical match using the InChIKey WSEQXVZVJXJVFP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WSEQXVZVJXJVFP
Search UniChem for chemical match using the InChIKey WSEQXVZVJXJVFP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WSEQXVZVJXJVFP