compound 17 [PMID: 23916253]

Ligand id: 8666

Name: compound 17 [PMID: 23916253]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 6
Rotatable bonds 14
Topological polar surface area 173.56
Molecular weight 441.24
XLogP -1.29
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Papakyriakou A, Zervoudi E, Theodorakis EA, Saveanu L, Stratikos E, Vourloumis D. (2013)
Novel selective inhibitors of aminopeptidases that generate antigenic peptides.
Bioorg. Med. Chem. Lett., 23 (17): 4832-6. [PMID:23916253]