KB-74935

Ligand id: 7370

Name: KB-74935

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 92.09
Molecular weight 479.07
XLogP 3.62
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-chloro-4-[(2R)-4-[4-fluoro-2-(trifluoromethyl)phenyl]-2-methylpiperazin-1-yl]sulfonylbenzamide
Synonyms
KB 74935
Database Links
CAS Registry No. 946398-78-3 (source: Scifinder)
ChEMBL Ligand CHEMBL550175
PubChem CID 44160268
RCSB PDB Ligand 33T
Search Google for chemical match using the InChIKey OMWNFYWEMXUREB-LLVKDONJSA-N
Search Google for chemicals with the same backbone OMWNFYWEMXUREB
Search UniChem for chemical match using the InChIKey OMWNFYWEMXUREB-LLVKDONJSA-N
Search UniChem for chemicals with the same backbone OMWNFYWEMXUREB