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Ligand

NameCHEMBL1951882
Molecular formulaC19H14BrN3OS
IUPAC name5-(4-bromophenyl)-13-(cyclopropylamino)-8-thia-5,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
Molecular weight412.305
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.9
SynonymsSCHEMBL8235268
BDBM50364710
Inchi KeyAIKMKUBZPSFYFF-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H14BrN3OS/c20-11-1-5-13(6-2-11)23-10-8-14-16-15(22-12-3-4-12)7-9-21-18(16)25-17(14)19(23)24/h1-2,5-10,12H,3-4H2,(H,21,22)
PubChem CID16118686
ChEMBLCHEMBL1951882
IUPHARN/A
BindingDB50364710
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
6310Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
6311Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199

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