compound 14 [PMID: 21155570]

Ligand id: 6323

Name: compound 14 [PMID: 21155570]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 92.14
Molecular weight 479.1
XLogP 7.07
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-chloro-5-(3-{[(2-cyclopentyl-3-oxo-2,3-dihydro-1,2-benzothiazol-6-yl)oxy]methyl}phenyl)benzoic acid
Database Links
ChEMBL Ligand CHEMBL1651219
GtoPdb PubChem SID 178102941
PubChem CID 46182736
Search Google for chemical match using the InChIKey ZQBPXBADOJMCRU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZQBPXBADOJMCRU
Search UniChem for chemical match using the InChIKey ZQBPXBADOJMCRU-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZQBPXBADOJMCRU