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Ligand

NameCHEMBL31714
Molecular formulaC29H21FN4OS
IUPAC name5-fluoro-2-[(E)-2-[3-[[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenoxy]methyl]phenyl]ethenyl]-1,3-benzothiazole
Molecular weight492.572
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP6.8
SynonymsSCHEMBL9334977
BDBM50284690
CP-96021
SCHEMBL9527363
1-(4-{3-[(E)-2-(5-Fluoro-benzothiazol-2-yl)-vinyl]-benzyloxy}-phenyl)-2-methyl-1H-imidazo[4,5-c]pyridine
[ Show all ]
Inchi KeyDXTYGLAQRALLEG-LFYBBSHMSA-N
Inchi IDInChI=1S/C29H21FN4OS/c1-19-32-26-17-31-14-13-27(26)34(19)23-7-9-24(10-8-23)35-18-21-4-2-3-20(15-21)5-12-29-33-25-16-22(30)6-11-28(25)36-29/h2-17H,18H2,1H3/b12-5+
PubChem CID9848518
ChEMBLCHEMBL31714
IUPHARN/A
BindingDB50284690
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
71647Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
71649Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340
71650D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
71648Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
71651Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
71646Platelet-activating factor receptorP21556PTAFRCavia porcellus (Guinea pig)342

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