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Ligand

NameMLS000331147
Molecular formulaC22H23ClN2O3
IUPAC name(1R,2R,6R,7R,8R,12S)-5-(4-chlorophenyl)-10-cyclohexyl-3-oxa-4,10-diazatetracyclo[5.5.1.02,6.08,12]tridec-4-ene-9,11-dione
Molecular weight398.887
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.7
Synonyms(3aR,4R,4aR,7aS,8R,8aR)-3-(4-chlorophenyl)-6-cyclohexyl-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
1164466-15-2
AKOS005499896
CHEMBL1337683
HMS2581E19
[ Show all ]
Inchi KeyADBFFFZOCDLIKY-PYCASWLRSA-N
Inchi IDInChI=1S/C22H23ClN2O3/c23-12-8-6-11(7-9-12)19-18-14-10-15(20(18)28-24-19)17-16(14)21(26)25(22(17)27)13-4-2-1-3-5-13/h6-9,13-18,20H,1-5,10H2/t14-,15+,16+,17-,18+,20+/m0/s1
PubChem CID11911747
ChEMBLCHEMBL1337683
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2102Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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