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Ligand

NameCHEMBL127067
Molecular formulaC20H19BrClNO
IUPAC name1-(4-bromophenyl)-3-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]propan-1-one
Molecular weight404.732
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.8
Synonyms1-(4-Bromo-phenyl)-3-[4-(4-chloro-phenyl)-3,6-dihydro-2H-pyridin-1-yl]-propan-1-one
3-[[4-(4-Chlorophenyl)-1,2,3,6-tetrahydropyridin]-1-yl]-1-(4-bromophenyl)propan-1-one
BDBM50036723
Inchi KeyBGRWHVFEYKSPFE-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19BrClNO/c21-18-5-1-17(2-6-18)20(24)11-14-23-12-9-16(10-13-23)15-3-7-19(22)8-4-15/h1-9H,10-14H2
PubChem CID14970528
ChEMBLCHEMBL127067
IUPHARN/A
BindingDB50036723
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
23377D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444

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