compound 1 [PMID: 24900608]

Ligand id: 7800

Name: compound 1 [PMID: 24900608]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 60.46
Molecular weight 352.12
XLogP 2.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
6-[4-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile
Database Links
ChEMBL Ligand CHEMBL3092413
GtoPdb PubChem SID 223366131
PubChem CID 73211886
Search Google for chemical match using the InChIKey UGDJVSURAKMIPU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone UGDJVSURAKMIPU
Search UniChem for chemical match using the InChIKey UGDJVSURAKMIPU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone UGDJVSURAKMIPU