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Ligand

NameCHEMBL195351
Molecular formulaC24H23F3N4O2
IUPAC name(E)-N-(4-methyl-2-piperazin-1-ylquinolin-6-yl)-3-[4-(trifluoromethoxy)phenyl]prop-2-enamide
Molecular weight456.469
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP4.8
SynonymsBDBM50172430
SCHEMBL5910558
(E)-N-(4-Methyl-2-piperazin-1-yl-quinolin-6-yl)-3-(4-trifluoromethoxy-phenyl)-acrylamide
SCHEMBL5910563
Inchi KeyFXDDFPUEYPXKQX-RUDMXATFSA-N
Inchi IDInChI=1S/C24H23F3N4O2/c1-16-14-22(31-12-10-28-11-13-31)30-21-8-5-18(15-20(16)21)29-23(32)9-4-17-2-6-19(7-3-17)33-24(25,26)27/h2-9,14-15,28H,10-13H2,1H3,(H,29,32)/b9-4+
PubChem CID10456755
ChEMBLCHEMBL195351
IUPHARN/A
BindingDB50172430
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
894925-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
89491Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422
89490Melanin-concentrating hormone receptor 2Q969V1MCHR2Homo sapiens (Human)340

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