Ligand id: 7533

Name: lifitegrast

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 142.37
Molecular weight 614.07
XLogP 4.41
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Immunopharmacology Comments
Chronic inflammation is an important factor in the pathogenesis of dry eye. Lymphocyte function-associated antigen-1 [LFA-1, αLβ2, or (CD11a)/CD18] is a heterodimeric β2 integrin. Its interactions with intercellular adhesion molecule-1 (ICAM-1 or CD54) are critical to the adhesion, migration, and proliferation of T-cells at the inflammation sites and T-cell specific immune responses. LFA-1 antagonism of ICAM-1 as demonstrated by lifitegrast, is thus now a successful anti-inflammatory treatment [9]
Immunopharmacology Disease
Disease X-Refs Comment References
keratoconjunctivitis sicca Disease Ontology: DOID:12895
Approved drug for keratoconjunctivitis sicca.