compound 3d [PMID: 3941405]

Ligand id: 8622

Name: compound 3d [PMID: 3941405]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 78.91
Molecular weight 203.11
XLogP 0.07
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Thompson SA, Andrews PR, Hanzlik RP. (1986)
Carboxyl-modified amino acids and peptides as protease inhibitors.
J. Med. Chem., 29 (1): 104-11. [PMID:3941405]