[3H]tiagabine

Ligand id: 4685

Name: [3H]tiagabine    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 97.02
Molecular weight 375.13
XLogP 4.01
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl]piperidine-3-carboxylic acid
Database Links
ChEMBL Ligand CHEMBL1027
PubChem CID 60648
Search Google for chemical match using the InChIKey PBJUNZJWGZTSKL-MRXNPFEDSA-N
Search Google for chemicals with the same backbone PBJUNZJWGZTSKL
Search UniChem for chemical match using the InChIKey PBJUNZJWGZTSKL-MRXNPFEDSA-N
Search UniChem for chemicals with the same backbone PBJUNZJWGZTSKL
Wikipedia Tiagabine