isoguvacine

Ligand id: 4226

Name: isoguvacine

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 -0.39
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1,2,3,6-tetrahydropyridine-4-carboxylic acid
Database Links
CAS Registry No. 64603-90-3 (source: Scifinder)
ChEMBL Ligand CHEMBL39071
PubChem CID 3765
Search Google for chemical match using the InChIKey KRVDMABBKYMBHG-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KRVDMABBKYMBHG
Search UniChem for chemical match using the InChIKey KRVDMABBKYMBHG-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KRVDMABBKYMBHG
Wikipedia Isoguvacine