Ligand id: 6441

Name: sivelestat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 147.25
Molecular weight 434.11
XLogP 3.17
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Crocetti L, Giovannoni MP, Schepetkin IA, Quinn MT, Khlebnikov AI, Cilibrizzi A, Piaz VD, Graziano A, Vergelli C. (2011)
Design, synthesis and evaluation of N-benzoylindazole derivatives and analogues as inhibitors of human neutrophil elastase.
Bioorg. Med. Chem., 19 (15): 4460-72. [PMID:21741848]