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Ligand

NameCHEMBL322184
Molecular formulaC26H27N5O
IUPAC name2-[4-[2-(benzhydrylamino)acetyl]piperazin-1-yl]-2-pyridin-3-ylacetonitrile
Molecular weight425.536
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.7
Synonyms{4-[2-(Benzhydryl-amino)-acetyl]-piperazin-1-yl}-pyridin-3-yl-acetonitrile; trihydrochloride; hydrate
BDBM50003506
CHEMBL545771
SCHEMBL9853140
Inchi KeyDRCDQPZXYQNGGL-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H27N5O/c27-18-24(23-12-7-13-28-19-23)30-14-16-31(17-15-30)25(32)20-29-26(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-13,19,24,26,29H,14-17,20H2
PubChem CID10410156
ChEMBLCHEMBL322184
IUPHARN/A
BindingDB50003506
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
66831Platelet-activating factor receptorQ62035PtafrMus musculus (Mouse)341
66832Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342
66833Platelet-activating factor receptorP46002PtafrRattus norvegicus (Rat)341

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