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citalopram | Ligand page | IUPHAR/BPS Guide to PHARMACOLOGY

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Ligand id: 7547

Name: citalopram

View more information in the IUPHAR Pharmacology Education Project: 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 3.54 No. Lipinski's rules broken 0

Molecular properties generated using the

Classification Compound class Synthetic organic Approved drug? Yes (FDA (1998)) IUPAC Name 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile International Nonproprietary Names INN number INN 4138 citalopram Synonyms Celexa® | Cipramil® | LU-10171B Comments The marketed formulation is a racemic mixture of stereo-isomers. We show the non-isomeric molecule to represent this mixture. The S enantiomer is known as escitalopram. R-citalopram has PubChem CID 6101829.
Marketed formulations may contain citalopram hydrobromide (PubChem CID 77995). Database Links CAS Registry No. 59729-33-8 ChEBI CHEBI:3723 ChEMBL Ligand CHEMBL549 DrugBank Ligand DB00215 GtoPdb PubChem SID 223365883 PubChem CID 2771 Search Google for chemical match using the InChIKey WSEQXVZVJXJVFP-UHFFFAOYSA-N Search Google for chemicals with the same backbone WSEQXVZVJXJVFP Search PubMed clinical trials citalopram Search PubMed titles citalopram Search PubMed titles/abstracts citalopram Search UniChem for chemical match using the InChIKey WSEQXVZVJXJVFP-UHFFFAOYSA-N Search UniChem for chemicals with the same backbone WSEQXVZVJXJVFP Wikipedia Citalopram

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