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Ligand

NameCHEMBL3353505
Molecular formulaC23H22ClN3O5
IUPAC name2-[[1-[2-(1,2-benzoxazol-3-yl)acetyl]-2-methylazetidine-2-carbonyl]-[(4-chlorophenyl)methyl]amino]acetic acid
Molecular weight455.895
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.7
SynonymsBDBM50032276
SCHEMBL11295072
Inchi KeyCXBWWDHJWPDCRK-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22ClN3O5/c1-23(22(31)26(14-21(29)30)13-15-6-8-16(24)9-7-15)10-11-27(23)20(28)12-18-17-4-2-3-5-19(17)32-25-18/h2-9H,10-14H2,1H3,(H,29,30)
PubChem CID70556743
ChEMBLCHEMBL3353505
IUPHARN/A
BindingDB50032276
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
443804Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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