5-fluorouracil

Ligand id: 4789

Name: 5-fluorouracil

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 0
Topological polar surface area 65.72
Molecular weight 130.02
XLogP -0.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1962))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
Prodrug capecitabinefloxuridine
IUPAC Name
5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione
International Nonproprietary Names
INN number INN
1421 fluorouracil
Synonyms
Adrucil® | Carac®
Comments
Fluoroacil is the active metabolite of the prodrugs capecitabine and floxuridine.
Database Links
CAS Registry No. 51-21-8
ChEMBL Ligand CHEMBL185
DrugBank Ligand DB00544
GtoPdb PubChem SID 178101491
PubChem CID 3385
RCSB PDB Ligand URF
Search Google for chemical match using the InChIKey GHASVSINZRGABV-UHFFFAOYSA-N
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Search PubMed clinical trials fluorouracil
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Search UniChem for chemical match using the InChIKey GHASVSINZRGABV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GHASVSINZRGABV
Wikipedia 5-fluorouracil

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Tocris
5-Fluorouracil
Cat. No. 3257