undecanoic acid

Ligand id: 5533

Name: undecanoic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 37.3
Molecular weight 186.16
XLogP 4.73
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
Undecanoic acid
Synonyms
undecanoate | undecoic acid
Database Links
CAS Registry No. 112-37-8 (source: Scifinder)
ChEBI CHEBI:32368
ChEMBL Ligand CHEMBL108030
PubChem CID 8180
RCSB PDB Ligand 11A
Search Google for chemical match using the InChIKey ZDPHROOEEOARMN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZDPHROOEEOARMN
Search UniChem for chemical match using the InChIKey ZDPHROOEEOARMN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZDPHROOEEOARMN
Wikipedia Undecanoic_acid