AZD7624   Click here for help

GtoPdb Ligand ID: 11714

Synonyms: AZD-7624 | Example 259 [WO2009001132]
Immunopharmacology Ligand
Compound class: Synthetic organic
Comment: AZD7624 is a p38α MAPK inhibitor [4]. It was designed as an inhalable agent to provide local anti-inflammatory action in inflammatory lung conditions [2-3].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 96.76
Molecular weight 491.23
XLogP 4.27
No. Lipinski's rules broken 0
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Canonical SMILES CNCCOc1ccccc1C1(CC1)Nc1nccn(c1=O)c1cc(cc(c1C)F)C(=O)NC1CC1
Isomeric SMILES Cc1c(cc(cc1F)C(=O)NC1CC1)n1ccnc(c1=O)NC1(CC1)c1ccccc1OCCNC
InChI InChI=1S/C27H30FN5O3/c1-17-21(28)15-18(25(34)31-19-7-8-19)16-22(17)33-13-11-30-24(26(33)35)32-27(9-10-27)20-5-3-4-6-23(20)36-14-12-29-2/h3-6,11,13,15-16,19,29H,7-10,12,14H2,1-2H3,(H,30,32)(H,31,34)
Immunopharmacology Comments
p38α appears to be the isoform that is most relevant to lung inflammation. AZD7624 inhibits p38α and p38β isoforms in human alveolar macrophages, but it failed to provide any benefit in patients with COPD in clinical trial [2].