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Ligand

NameBDBM86273
Molecular formulaC18H17BrF3NO2
IUPAC name(5S)-9-bromo-3-methyl-5-[3-(trifluoromethyl)phenyl]-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol
Molecular weight416.238
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.6
SynonymsMCL-211
Inchi KeyFTKZFGGKMRGKQD-AWEZNQCLSA-N
Inchi IDInChI=1S/C18H17BrF3NO2/c1-23-6-5-12-13(8-15(24)17(25)16(12)19)14(9-23)10-3-2-4-11(7-10)18(20,21)22/h2-4,7-8,14,24-25H,5-6,9H2,1H3/t14-/m0/s1
PubChem CID57340518
ChEMBLN/A
IUPHARN/A
BindingDB86273
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5557925-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
86842Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458
86841D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
555791D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
555793D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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