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Ligand

NameCHEMBL103753
Molecular formulaC26H26N4O2
IUPAC name2-[4-(3-hydroxy-3,3-diphenylpropanoyl)piperazin-1-yl]-2-pyridin-3-ylacetonitrile
Molecular weight426.52
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.2
Synonyms[4-(3-Hydroxy-3,3-diphenyl-propionyl)-piperazin-1-yl]-pyridin-3-yl-acetonitrile; hydrate
BDBM50003510
SCHEMBL9852905
[4-(3-Hydroxy-3,3-diphenyl-propionyl)-piperazin-1-yl]-pyridin-3-yl-acetonitrile
Inchi KeyFMTWOXJEAYZPIZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26N4O2/c27-19-24(21-8-7-13-28-20-21)29-14-16-30(17-15-29)25(31)18-26(32,22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-13,20,24,32H,14-18H2
PubChem CID10410208
ChEMBLCHEMBL103753
IUPHARN/A
BindingDB50003510
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
82260Platelet-activating factor receptorQ62035PtafrMus musculus (Mouse)341
82261Platelet-activating factor receptorP46002PtafrRattus norvegicus (Rat)341
82262Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342

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