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Ligand

NameCHEMBL3422887
Molecular formulaC22H18FN3OS
IUPAC name6-benzoyl-2-[(4-fluorophenyl)methylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
Molecular weight391.464
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.8
SynonymsN/A
Inchi KeyBJGAJTMYBFSCLX-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H18FN3OS/c23-17-8-6-15(7-9-17)13-25-21-19(12-24)18-10-11-26(14-20(18)28-21)22(27)16-4-2-1-3-5-16/h1-9,25H,10-11,13-14H2
PubChem CID118735971
ChEMBLCHEMBL3422887
IUPHARN/A
BindingDB50083566
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
442647Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
442648Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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