compound 1b [PMID: 9871762]

Ligand id: 8794

Name: compound 1b [PMID: 9871762]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 11
Topological polar surface area 86.47
Molecular weight 474.2
XLogP 5.79
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

References
1. Gotteland JP, Loubat C, Planty B, Junquéro D, Delhon A, Halazy S. (1998)
Sulfonamide derivatives of benzylamine block cholesterol biosynthesis in HepG2 cells: a new type of potent squalene epoxidase inhibitors.
Bioorg. Med. Chem. Lett.8 (11): 1337-42. [PMID:9871762]