compound 4b [PMID: 19683441]

Ligand id: 7755

Name: compound 4b [PMID: 19683441]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 68.95
Molecular weight 494.21
XLogP 4.75
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Suzuki T, Kameda M, Ando M, Miyazoe H, Sekino E, Ito S, Masutani K, Kamijo K, Takezawa A, Moriya M et al.. (2009)
Discovery of novel diarylketoxime derivatives as selective and orally active melanin-concentrating hormone 1 receptor antagonists.
Bioorg. Med. Chem. Lett., 19 (18): 5339-45. [PMID:19683441]