Ligand id: 9330

Name: CDP840

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 31.35
Molecular weight 373.2
XLogP 8.29
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Harbinson PL, MacLeod D, Hawksworth R, O'Toole S, Sullivan PJ, Heath P, Kilfeather S, Page CP, Costello J, Holgate ST, Lee TH. (1997)
The effect of a novel orally active selective PDE4 isoenzyme inhibitor (CDP840) on allergen-induced responses in asthmatic subjects.
Eur Respir J., 10 (5): 1008-14. [PMID:9163639]
2. Kodimuthali A, Jabaris SS, Pal M. (2008)
Recent advances on phosphodiesterase 4 inhibitors for the treatment of asthma and chronic obstructive pulmonary disease.
J. Med. Chem., 51 (18): 5471-89. [PMID:18686943]
3. Perry MJ, O'Connell J, Walker C, Crabbe T, Baldock D, Russell A, Lumb S, Huang Z, Howat D, Allen R et al.. (1998)
CDP840: a novel inhibitor of PDE-4.
Cell Biochem Biophys., 29: 113-32. [PMID:9631241]