Ligand Id: 722
Ligand name L-citrulline

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 118.44
Molecular weight 175.1
XLogP -3.91
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
Approved drug? Yes (source: DrugBank)
DrugBank groups approved; nutraceutical
IUPAC Name
(2S)-2-amino-5-(carbamoylamino)pentanoic acid
Database Links
CAS Registry No. 372-75-8 (source: DrugBank)
ChEBI CHEBI:16349
ChEMBL Ligand 554243, 412213
DrugBank Ligand DB00155
Human Metabolome Database HMDB00904
PharmGKB Drug PA164747225
PubChem CID 9750
RCSB PDB Ligand CIR
Search on ChemSpider RHGKLRLOHDJJDR-BYPYZUCNSA-N
Wikipedia Citrulline
ZINC ZINC01532614

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

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