compound 29f [PMID: 17560788]

Ligand id: 2959

Name: compound 29f [PMID: 17560788]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 14
Topological polar surface area 154.75
Molecular weight 538.21
XLogP 2.83
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Bratton LD, Auerbach B, Choi C, Dillon L, Hanselman JC, Larsen SD, Lu G, Olsen K, Pfefferkorn JA, Robertson A et al.. (2007)
Discovery of pyrrole-based hepatoselective ligands as potent inhibitors of HMG-CoA reductase.
Bioorg. Med. Chem., 15 (16): 5576-89. [PMID:17560788]