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Ligand

NameCHEMBL1672280
Molecular formulaC12H4BrFN2S
IUPAC name3-[2-(2-bromo-1,3-thiazol-4-yl)ethynyl]-5-fluorobenzonitrile
Molecular weight307.14
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.9
Synonyms3-((2-Bromothiazol)-4-ethynyl)-5-fluorobenzonitrile
BDBM50336835
3-((2-bromothiazol-4-yl)ethynyl)-5-fluorobenzonitrile
1262778-34-6
Inchi KeyABAUFLMLBRRLAN-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H4BrFN2S/c13-12-16-11(7-17-12)2-1-8-3-9(6-15)5-10(14)4-8/h3-5,7H
PubChem CID51050150
ChEMBLCHEMBL1672280
IUPHARN/A
BindingDB50336835
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
715Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203

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