SSR240612

Ligand id: 662

Name: SSR240612

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 16
Topological polar surface area 134.89
Molecular weight 756.36
XLogP 7.22
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2R)-2-[[(3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxynaphthalen-2-yl)sulfonylamino]propanoyl]amino]-3-[4-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]methyl]phenyl]-N-methyl-N-propan-2-ylpropanamide
Database Links
CAS Registry No. 465539-70-2 (source: Scifinder)
ChEMBL Ligand CHEMBL2021721
PubChem CID 9853583
Search Google for chemical match using the InChIKey QGWIQIAWOCJRPI-WSCVWKGISA-N
Search Google for chemicals with the same backbone QGWIQIAWOCJRPI
Search UniChem for chemical match using the InChIKey QGWIQIAWOCJRPI-WSCVWKGISA-N
Search UniChem for chemicals with the same backbone QGWIQIAWOCJRPI