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Ligand

NameCHEMBL122008
Molecular formulaC23H24FN3O3
IUPAC name5-[(Z)-[3-(4-fluorophenyl)-2-imidazol-1-yl-1-phenylpropylidene]amino]oxypentanoic acid
Molecular weight409.461
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
Synonyms5-[[[(E)-1-Phenyl-2-(1H-imidazol-1-yl)-3-(4-fluorophenyl)propylidene]amino]oxy]pentanoic acid
BDBM50037751
(+/-) (E)-5-[1-phenyl-2-(imidazol-1-yl)-2-(4-fluorobenzyl)ethylidene] aminoxypentanoic acid
SCHEMBL9423341
5-[3-(4-Fluoro-phenyl)-2-imidazol-1-yl-1-phenyl-prop-(Z)-ylideneaminooxy]-pentanoic acid
[ Show all ]
Inchi KeyAFEOYNXQWALUNY-RWEWTDSWSA-N
Inchi IDInChI=1S/C23H24FN3O3/c24-20-11-9-18(10-12-20)16-21(27-14-13-25-17-27)23(19-6-2-1-3-7-19)26-30-15-5-4-8-22(28)29/h1-3,6-7,9-14,17,21H,4-5,8,15-16H2,(H,28,29)/b26-23-
PubChem CID9931330
ChEMBLCHEMBL122008
IUPHARN/A
BindingDB50037751
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
4105Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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