compound 27 [PMID: 18337095]

Ligand id: 8158

Name: compound 27 [PMID: 18337095]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 92.91
Molecular weight 404.1
XLogP 3.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Lu Q, Chen Z, Perumattam J, Wang DX, Liang W, Xu YJ, Do S, Bonaga L, Higaki J, Dong H et al.. (2008)
Aryl-indolyl maleimides as inhibitors of CaMKIIdelta. Part 3: Importance of the indole orientation.
Bioorg. Med. Chem. Lett., 18 (7): 2399-403. [PMID:18337095]