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Ligand

NameCHEMBL103561
Molecular formulaC28H31N5O
IUPAC name2-[4-[2-(1,1-diphenylethylamino)acetyl]piperazin-1-yl]-2-(2-methylpyridin-3-yl)acetonitrile
Molecular weight453.59
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50045997
SCHEMBL9575072
{4-[2-(1,1-Diphenyl-ethylamino)-acetyl]-piperazin-1-yl}-(2-methyl-pyridin-3-yl)-acetonitrile
Inchi KeyBSMSADGDBGATQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H31N5O/c1-22-25(14-9-15-30-22)26(20-29)32-16-18-33(19-17-32)27(34)21-31-28(2,23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-15,26,31H,16-19,21H2,1-2H3
PubChem CID10095446
ChEMBLCHEMBL103561
IUPHARN/A
BindingDB50045997
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
31795Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342
31796Platelet-activating factor receptorP46002PtafrRattus norvegicus (Rat)341
31797Platelet-activating factor receptorQ62035PtafrMus musculus (Mouse)341

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