compound 7 [PMID: 24825313]

Ligand id: 7531

Name: compound 7 [PMID: 24825313]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 91.42
Molecular weight 380.17
XLogP 3.1
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Chojnacki JE, Liu K, Yan X, Toldo S, Selden T, Estrada M, Rodríguez-Franco MI, Halquist MS, Ye D, Zhang S. (2014)
Discovery of 5-(4-hydroxyphenyl)-3-oxo-pentanoic acid [2-(5-methoxy-1H-indol-3-yl)-ethyl]-amide as a neuroprotectant for Alzheimer's disease by hybridization of curcumin and melatonin.
ACS Chem Neurosci, 5 (8): 690-9. [PMID:24825313]