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Ligand

NameBDBM86264
Molecular formulaC18H20BrNO2
IUPAC name9-bromo-3-methyl-5-(4-methylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol
Molecular weight362.267
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.1
SynonymsMCL-212
Inchi KeyLBIPTTYQIBCFPG-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20BrNO2/c1-11-3-5-12(6-4-11)15-10-20(2)8-7-13-14(15)9-16(21)18(22)17(13)19/h3-6,9,15,21-22H,7-8,10H2,1-2H3
PubChem CID57340511
ChEMBLN/A
IUPHARN/A
BindingDB86264
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5562105-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471
183256Alpha-2C adrenergic receptorP22086Adra2cRattus norvegicus (Rat)458
183255D(1A) dopamine receptorP18901Drd1Rattus norvegicus (Rat)446
183257D(1B) dopamine receptorP21918DRD5Homo sapiens (Human)477
556212D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444
556211D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400

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