Ligand id: 6532

Name: CAA0225

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 14
Topological polar surface area 120.06
Molecular weight 487.21
XLogP 2.67
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Takahashi K, Ueno T, Tanida I, Minematsu-Ikeguchi N, Murata M, Kominami E. (2009)
Characterization of CAA0225, a novel inhibitor specific for cathepsin L, as a probe for autophagic proteolysis.
Biol. Pharm. Bull., 32 (3): 475-9. [PMID:19252298]