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Ligand

NameCHEMBL1774236
Molecular formulaC21H22F4N4O
IUPAC name2-[[(3S,4S)-4-[2-fluoro-4-(trifluoromethoxy)phenyl]-3-methylpiperidin-1-yl]methyl]-1-methylimidazo[4,5-b]pyridine
Molecular weight422.428
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP4.5
SynonymsBDBM50343328
cis-2-(((3S,4S)-4-(2-fluoro-4-(trifluoromethoxy)phenyl)-3-methylpiperidin-1-yl)methyl)-1-methyl-1H-imidazo[4,5-b]pyridine
Inchi KeyCQTZXNPIJZSXKK-HIFRSBDPSA-N
Inchi IDInChI=1S/C21H22F4N4O/c1-13-11-29(12-19-27-20-18(28(19)2)4-3-8-26-20)9-7-15(13)16-6-5-14(10-17(16)22)30-21(23,24)25/h3-6,8,10,13,15H,7,9,11-12H2,1-2H3/t13-,15+/m1/s1
PubChem CID51354020
ChEMBLCHEMBL1774236
IUPHARN/A
BindingDB50343328
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
48405Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
558760Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872

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