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Ligand

NameCHEMBL3691852
Molecular formulaC20H18F3N7O
IUPAC name[2-(triazol-2-yl)phenyl]-[6-[[5-(trifluoromethyl)pyrazin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
Molecular weight429.407
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.8
SynonymsSCHEMBL16092118
US8969352, 59
BDBM143798
Inchi KeyFFRFKFZPBDAESX-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18F3N7O/c21-20(22,23)17-9-25-18(10-24-17)28-14-7-12-8-16(14)29(11-12)19(31)13-3-1-2-4-15(13)30-26-5-6-27-30/h1-6,9-10,12,14,16H,7-8,11H2,(H,25,28)
PubChem CID86270844
ChEMBLCHEMBL3691852
IUPHARN/A
BindingDB143798
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
472425Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
517711Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
472424Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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