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Ligand

NameCHEMBL3352999
Molecular formulaC22H25ClN2O2
IUPAC nameN-[(4-chlorophenyl)methyl]-1-[2-(3,5-dimethylphenyl)acetyl]-2-methylazetidine-2-carboxamide
Molecular weight384.904
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP3.9
SynonymsBDBM50032307
Inchi KeyCQHJBLXNEJTJJX-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25ClN2O2/c1-15-10-16(2)12-18(11-15)13-20(26)25-9-8-22(25,3)21(27)24-14-17-4-6-19(23)7-5-17/h4-7,10-12H,8-9,13-14H2,1-3H3,(H,24,27)
PubChem CID118719384
ChEMBLCHEMBL3352999
IUPHARN/A
BindingDB50032307
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
443584Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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