compound 5k [PMID: 23528296]

Ligand id: 8801

Name: compound 5k [PMID: 23528296]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 89.6
Molecular weight 375.15
XLogP 2.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Matsufuji T, Ikeda M, Naito A, Hirouchi M, Kanda S, Izumi M, Harada J, Shinozuka T. (2013)
Arylpiperazines as fatty acid transport protein 1 (FATP1) inhibitors with improved potency and pharmacokinetic properties.
Bioorg. Med. Chem. Lett.23 (9): 2560-5. [PMID:23528296]