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Ligand

NameCitronellyloxyacetaldehyde
Molecular formulaC12H22O2
IUPAC name2-(3,7-dimethyloct-6-enoxy)acetaldehyde
Molecular weight198.306
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP3.3
Synonyms2-(3,7-dimethyloct-6-enyloxy)acetaldehyde
Acetaldehyde, 2-((3,7-dimethyl-6-octen-1-yl)oxy)-
C-52046
EINECS 231-324-2
Muguet aldehyde
[ Show all ]
Inchi KeyLMETVDMCIJNNKH-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H22O2/c1-11(2)5-4-6-12(3)7-9-14-10-8-13/h5,8,12H,4,6-7,9-10H2,1-3H3
PubChem CID61401
ChEMBLCHEMBL3729330
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
527017Olfactory receptor 5K1Q8NHB7OR5K1Homo sapiens (Human)308

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