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Ligand

NameCHEMBL338940
Molecular formulaC26H26N4O2
IUPAC name2-[4-(3-hydroxy-3,3-diphenylpropanoyl)piperazin-1-yl]-2-pyridin-4-ylacetonitrile
Molecular weight426.52
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.2
SynonymsBDBM50003499
SCHEMBL9852997
[4-(3-Hydroxy-3,3-diphenyl-propionyl)-piperazin-1-yl]-pyridin-4-yl-acetonitrile; hydrate
Inchi KeyFQQHZKLGYQTVQN-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26N4O2/c27-20-24(21-11-13-28-14-12-21)29-15-17-30(18-16-29)25(31)19-26(32,22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-14,24,32H,15-19H2
PubChem CID10455159
ChEMBLCHEMBL338940
IUPHARN/A
BindingDB50003499
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
84964Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342
84965Platelet-activating factor receptorP46002PtafrRattus norvegicus (Rat)341
84966Platelet-activating factor receptorQ62035PtafrMus musculus (Mouse)341

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