TD-8954

Ligand id: 8426

Name: TD-8954

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 90.56
Molecular weight 455.29
XLogP 3.05
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl 4-[[4-[[(2-propan-2-yl1H-benzimidazole-4-carbonyl)amino]methyl]piperidin-1-yl]methyl]piperidine-1-carboxylate
Synonyms
compound 18 [PMID 23756062]
Database Links
ChEMBL Ligand CHEMBL2402904
PubChem CID 11961293
Search Google for chemical match using the InChIKey MZOITCJKGUIQEI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MZOITCJKGUIQEI
Search UniChem for chemical match using the InChIKey MZOITCJKGUIQEI-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MZOITCJKGUIQEI
Comments
TD-8954 is a potent and selective agonist of the 5-HT4 receptor [2,7]. The compound is being investigated for its gastrointestinal prokinetic action.