12R-HETE

Ligand id: 3405

Name: 12R-HETE

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 14
Topological polar surface area 57.53
Molecular weight 320.24
XLogP 6.22
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

References
1. Okuno T, Iizuka Y, Okazaki H, Yokomizo T, Taguchi R, Shimizu T. (2008)
12(S)-Hydroxyheptadeca-5Z, 8E, 10E-trienoic acid is a natural ligand for leukotriene B4 receptor 2.
J. Exp. Med., 205 (4): 759-66. [PMID:18378794]
2. Yokomizo T, Izumi T, Chang K, Takuwa Y, Shimizu T. (1997)
A G-protein-coupled receptor for leukotriene B4 that mediates chemotaxis.
Nature, 387: 620-624. [PMID:9177352]
3. Yokomizo T, Kato K, Hagiya H, Izumi T, Shimizu T. (2001)
Hydroxyeicosanoids bind to and activate the low affinity leukotriene B4 receptor, BLT2.
J. Biol. Chem., 276 (15): 12454-9. [PMID:11278893]