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Ligand

NameCHEMBL3702393
Molecular formulaC22H22N6O
IUPAC name2-(1-propan-2-ylpyrazol-4-yl)-9-pyrazol-1-yl-7,8-dihydro-4H-[1,4]diazepino[7,1-a]isoquinolin-5-one
Molecular weight386.459
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP1.8
SynonymsBDBM135988
SCHEMBL15487716
US8853203, 42
Inchi KeyBQUBBDZDEOJEQD-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H22N6O/c1-15(2)28-14-16(12-25-28)19-11-21-17-5-3-6-20(27-9-4-8-24-27)18(17)7-10-26(21)22(29)13-23-19/h3-6,8-9,11-12,14-15H,7,10,13H2,1-2H3
PubChem CID73335440
ChEMBLCHEMBL3702393
IUPHARN/A
BindingDB135988
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
459483Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
459482Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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