arecaidine

Ligand id: 9487

Name: arecaidine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 40.54
Molecular weight 141.08
XLogP -0.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-methyl-5,6-dihydro-2H-pyridine-3-carboxylic acid
Synonyms
methylguvacine | N-methylguvacine
Database Links
CAS Registry No. 499-04-7 (source: PubChem)
ChEMBL Ligand CHEMBL432561
PubChem CID 10355
Search Google for chemical match using the InChIKey DNJFTXKSFAMXQF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DNJFTXKSFAMXQF
Search UniChem for chemical match using the InChIKey DNJFTXKSFAMXQF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DNJFTXKSFAMXQF
Comments
Arecaidine is an alkaloid found in betel nuts (Areca catechu).