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Ligand

NameCHEMBL1093902
Molecular formulaC16H10F3N5OS
IUPAC name13-amino-5-(4-methylphenyl)-11-(trifluoromethyl)-8-thia-3,5,10,12-tetrazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
Molecular weight377.345
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.3
SynonymsSCHEMBL8246066
BDBM50316009
9-Amino-3-p-tolyl-7-trifluoromethyl-3H-thieno[2,3-d:4,5-d'']dipyrimidin-4-one
Inchi KeyCEQZVMIHPFXAMJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H10F3N5OS/c1-7-2-4-8(5-3-7)24-6-21-10-9-12(20)22-15(16(17,18)19)23-13(9)26-11(10)14(24)25/h2-6H,1H3,(H2,20,22,23)
PubChem CID46886119
ChEMBLCHEMBL1093902
IUPHARN/A
BindingDB50316009
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
40177Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
40178Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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