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Ligand

NameCHEMBL3785252
Molecular formulaC21H17ClN2O3
IUPAC nameN-[3-chloro-4-(1-oxo-3,4-dihydroisoquinolin-2-yl)phenyl]-3-methylfuran-2-carboxamide
Molecular weight380.828
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.2
SynonymsBDBM50159576
Inchi KeyBXIWLGFZMVSNKL-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H17ClN2O3/c1-13-9-11-27-19(13)20(25)23-15-6-7-18(17(22)12-15)24-10-8-14-4-2-3-5-16(14)21(24)26/h2-7,9,11-12H,8,10H2,1H3,(H,23,25)
PubChem CID127033961
ChEMBLCHEMBL3785252
IUPHARN/A
BindingDB50159576
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
522586Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194

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