pecazine

Ligand id: 9782

Name: pecazine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 31.78
Molecular weight 310.15
XLogP 4.68
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Schlauderer F, Lammens K, Nagel D, Vincendeau M, Eitelhuber AC, Verhelst SH, Kling D, Chrusciel A, Ruland J, Krappmann D et al.. (2013)
Structural analysis of phenothiazine derivatives as allosteric inhibitors of the MALT1 paracaspase.
Angew. Chem. Int. Ed. Engl., 52 (39): 10384-7. [PMID:23946259]