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Ligand

NameCHEMBL3702428
Molecular formulaC22H19N5O
IUPAC name2-(4-methylimidazol-1-yl)-9-pyridin-4-yl-7,8-dihydro-4H-[1,4]diazepino[7,1-a]isoquinolin-5-one
Molecular weight369.428
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.0
SynonymsBDBM136025
SCHEMBL15487876
US8853203, 80
Inchi KeyCAVPDUPKFCVXKI-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H19N5O/c1-15-13-26(14-25-15)21-11-20-19-4-2-3-17(16-5-8-23-9-6-16)18(19)7-10-27(20)22(28)12-24-21/h2-6,8-9,11,13-14H,7,10,12H2,1H3
PubChem CID73335643
ChEMBLCHEMBL3702428
IUPHARN/A
BindingDB136025
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
459554Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
459555Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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