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Ligand

NameCHEMBL3132966
Molecular formulaC20H19ClN4O2
IUPAC nameN-(4-chlorophenyl)-5-cyclopropyl-3-(3-methoxyphenyl)-N-methyltriazole-4-carboxamide
Molecular weight382.848
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.9
SynonymsN-Methyl-N-(4-chlorophenyl)-1-(3-methoxyphenyl)-4-cyclopropyl-1H-1,2,3-triazole-5-carboxamide
Inchi KeyAGKYBJAEPMUCHJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H19ClN4O2/c1-24(15-10-8-14(21)9-11-15)20(26)19-18(13-6-7-13)22-23-25(19)16-4-3-5-17(12-16)27-2/h3-5,8-13H,6-7H2,1-2H3
PubChem CID76314787
ChEMBLCHEMBL3132966
IUPHARN/A
BindingDBN/A
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
4981G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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