Ligand id: 8803

Name: apstatin

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 11
Topological polar surface area 159.06
Molecular weight 459.25
XLogP -1.07
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Maggiora LL, Orawski AT, Simmons WH. (1999)
Apstatin analogue inhibitors of aminopeptidase P, a bradykinin-degrading enzyme.
J. Med. Chem., 42 (13): 2394-402. [PMID:10395480]
2. Prechel MM, Orawski AT, Maggiora LL, Simmons WH. (1995)
Effect of a new aminopeptidase P inhibitor, apstatin, on bradykinin degradation in the rat lung.
J. Pharmacol. Exp. Ther., 275 (3): 1136-42. [PMID:8531074]