compound 16f [PMID: 18155906]

Ligand id: 3011

Name: compound 16f [PMID: 18155906]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 15
Topological polar surface area 180.33
Molecular weight 669.23
XLogP 4.87
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Park WK, Kennedy RM, Larsen SD, Miller S, Roth BD, Song Y, Steinbaugh BA, Sun K, Tait BD, Kowala MC et al.. (2008)
Hepatoselectivity of statins: design and synthesis of 4-sulfamoyl pyrroles as HMG-CoA reductase inhibitors.
Bioorg. Med. Chem. Lett., 18 (3): 1151-6. [PMID:18155906]