CID2440433

Ligand id: 5565

Name: CID2440433

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 72.55
Molecular weight 470.24
XLogP 3.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-N,N-dimethyl-4-pyrrolidin-1-ylbenzenesulfonamide
Synonyms
CID 2440433
Database Links
CAS Registry No. 794572-10-4 (source: Scifinder)
ChEMBL Ligand CHEMBL1385076
GtoPdb PubChem SID 178102203
PubChem CID 2440433
Search Google for chemical match using the InChIKey VRSJAHQGJHDACS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VRSJAHQGJHDACS
Search UniChem for chemical match using the InChIKey VRSJAHQGJHDACS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VRSJAHQGJHDACS