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Ligand

NameSMR000471039
Molecular formulaC33H29BrFN3O4
IUPAC name(1S,2R,7S,8R)-2-benzyl-4-(4-bromophenyl)-10-cyclohexyl-7-(4-fluorophenyl)-4,6,10-triazatricyclo[6.3.0.02,6]undecane-3,5,9,11-tetrone
Molecular weight630.514
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.6
SynonymsMLS001075044
CHEMBL1513056
MLS003231174
HMS2199M11
Inchi KeyADZFHVKIISBZLA-UJCZQSIQSA-N
Inchi IDInChI=1S/C33H29BrFN3O4/c34-22-13-17-25(18-14-22)37-31(41)33(19-20-7-3-1-4-8-20)27-26(29(39)36(30(27)40)24-9-5-2-6-10-24)28(38(33)32(37)42)21-11-15-23(35)16-12-21/h1,3-4,7-8,11-18,24,26-28H,2,5-6,9-10,19H2/t26-,27-,28-,33-/m1/s1
PubChem CID24792653
ChEMBLCHEMBL1513056
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3252Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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