urea

Ligand id: 4539

Name: urea

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 0
Topological polar surface area 69.11
Molecular weight 60.03
XLogP -1.69
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
urea
Database Links
CAS Registry No. 57-13-6 (source: Scifinder)
ChEBI CHEBI:16199
ChEMBL Ligand CHEMBL985
DrugBank Ligand DB03904
PubChem CID 1176
RCSB PDB Ligand URE
Search Google for chemical match using the InChIKey XSQUKJJJFZCRTK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XSQUKJJJFZCRTK
Search UniChem for chemical match using the InChIKey XSQUKJJJFZCRTK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone XSQUKJJJFZCRTK
Wikipedia Urea