diamide 7

Ligand id: 5830

Name: diamide 7

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 106.67
Molecular weight 394.14
XLogP 5.68
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Unitt J, Fagura M, Phillips T, King S, Perry M, Morley A, MacDonald C, Weaver R, Christie J, Barber S et al.. (2011)
Discovery of small molecule human FPR1 receptor antagonists.
Bioorg. Med. Chem. Lett., 21 (10): 2991-7. [PMID:21486695]