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Ligand

NameCHEMBL3936050
Molecular formulaC26H26FN5O
IUPAC name4-(4-fluorophenyl)-7-[[4-(4-methylimidazol-1-yl)piperidin-1-yl]methyl]quinoline-2-carboxamide
Molecular weight443.526
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.6
SynonymsBDBM212963
SCHEMBL14933123
US9278960, 4-47
Inchi KeyAXPVOPNKHPVYOZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26FN5O/c1-17-14-32(16-29-17)21-8-10-31(11-9-21)15-18-2-7-22-23(19-3-5-20(27)6-4-19)13-25(26(28)33)30-24(22)12-18/h2-7,12-14,16,21H,8-11,15H2,1H3,(H2,28,33)
PubChem CID89554950
ChEMBLCHEMBL3936050
IUPHARN/A
BindingDBN/A
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
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GLASS IDNameUniProtGeneSpeciesLength
536423Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872

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