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Ligand

NameCHEMBL1951889
Molecular formulaC18H16N4OS
IUPAC name3-(ethylamino)-11-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,12-pentaen-10-one
Molecular weight336.413
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50364717
SCHEMBL8242003
Inchi KeyCNFAEBPKUNACJT-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H16N4OS/c1-3-19-16-14-13-8-9-22(12-6-4-11(2)5-7-12)18(23)15(13)24-17(14)21-10-20-16/h4-10H,3H2,1-2H3,(H,19,20,21)
PubChem CID16118942
ChEMBLCHEMBL1951889
IUPHARN/A
BindingDB50364717
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
45980Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199
45981Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194

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