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Ligand

NameCHEMBL3582025
Molecular formulaC21H27N3O4
IUPAC name2-(5-amino-1,2-oxazol-3-yl)propan-2-yl 5-cyclopentyl-6-(cyclopropylmethoxy)pyridine-2-carboxylate
Molecular weight385.464
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50090954
Inchi KeyDHKPUFSJXNHFGU-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H27N3O4/c1-21(2,17-11-18(22)28-24-17)27-20(25)16-10-9-15(14-5-3-4-6-14)19(23-16)26-12-13-7-8-13/h9-11,13-14H,3-8,12,22H2,1-2H3
PubChem CID122179280
ChEMBLCHEMBL3582025
IUPHARN/A
BindingDB50090954
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
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GLASS IDNameUniProtGeneSpeciesLength
470340Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
470341Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347

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