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Ligand

NameCHEMBL3321848
Molecular formulaC21H20Cl2N2O2
IUPAC nameN-(2,5-dichlorophenyl)-1-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-methylcyclopropane-1-carboxamide
Molecular weight403.303
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.5
SynonymsBDBM50100566
Inchi KeyCMZPQXQHRWHNBS-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20Cl2N2O2/c1-24(18-13-15(22)8-9-16(18)23)19(26)21(10-11-21)20(27)25-12-4-6-14-5-2-3-7-17(14)25/h2-3,5,7-9,13H,4,6,10-12H2,1H3
PubChem CID118709775
ChEMBLCHEMBL3321848
IUPHARN/A
BindingDB50100566
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
443476G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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