compound 27 [PMID: 19854648]

Ligand id: 8168

Name: compound 27 [PMID: 19854648]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 76.24
Molecular weight 403.05
XLogP 3.23
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Rosen MD, Woods CR, Goldberg SD, Hack MD, Bounds AD, Yang Y, Wagaman PC, Phuong VK, Ameriks AP, Barrett TD et al.. (2009)
Discovery of the first known small-molecule inhibitors of heme-regulated eukaryotic initiation factor 2alpha (HRI) kinase.
Bioorg. Med. Chem. Lett., 19 (23): 6548-51. [PMID:19854648]