guvacine

Ligand id: 4691

Name: guvacine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 49.33
Molecular weight 127.06
XLogP 0.04
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
1,2,5,6-tetrahydropyridine-3-carboxylic acid
Database Links
CAS Registry No. 498-96-4 (source: Scifinder)
ChEBI CHEBI:5576
ChEMBL Ligand CHEMBL76768
DrugBank Ligand DB08848
PubChem CID 3532
Search Google for chemical match using the InChIKey QTDZOWFRBNTPQR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QTDZOWFRBNTPQR
Wikipedia Guvacine
Comments
A pyridine alkaloid found in the Areca nut.