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Ligand

NameCHEMBL1098212
Molecular formulaC16H9F3N2O3S2
IUPAC name[2-cyano-4-(2-methyl-1,3-benzothiazol-5-yl)phenyl] trifluoromethanesulfonate
Molecular weight398.374
Hydrogen bond acceptor9
Hydrogen bond donor0
XlogP4.9
SynonymsBDBM50317843
2-Cyano-4-(2-methylbenzo[d]thiazol-5-yl)phenyl trifluoromethanesulfonate
Inchi KeyGXRHWBFQOVAGDT-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H9F3N2O3S2/c1-9-21-13-7-11(3-5-15(13)25-9)10-2-4-14(12(6-10)8-20)24-26(22,23)16(17,18)19/h2-7H,1H3
PubChem CID46888002
ChEMBLCHEMBL1098212
IUPHARN/A
BindingDB50317843
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
107853Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
107849Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872
107850Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912
107851Metabotropic glutamate receptor 5P31424Grm5Rattus norvegicus (Rat)1203
107854Metabotropic glutamate receptor 6O15303GRM6Homo sapiens (Human)877
107852Metabotropic glutamate receptor 8O00222GRM8Homo sapiens (Human)908

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