compound 30 [PMID: 21757343]

Ligand id: 6407

Name: compound 30 [PMID: 21757343]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 74.33
Molecular weight 383.09
XLogP 4.47
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-(3-chlorophenyl)-4-methyl-5-[(2R)-1-[(1,3-thiazol-2-yl)carbonyl]pyrrolidin-2-yl]pyridine
Database Links
ChEMBL Ligand CHEMBL1808901
GtoPdb PubChem SID 178103023
PubChem CID 53380924
Search Google for chemical match using the InChIKey GCSDBTCZHROCLZ-GOSISDBHSA-N
Search Google for chemicals with the same backbone GCSDBTCZHROCLZ
Search UniChem for chemical match using the InChIKey GCSDBTCZHROCLZ-GOSISDBHSA-N
Search UniChem for chemicals with the same backbone GCSDBTCZHROCLZ