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Ligand

NameAC1NIMSY
Molecular formulaC26H34N4O6
IUPAC name4-(azepan-1-yl)-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methyl-3-nitrobenzamide
Molecular weight498.58
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.1
SynonymsMLS001079113
CHEMBL1705416
MolPort-004-451-241
HMS3033M06
ZINC9285761
[ Show all ]
Inchi KeyACHIHCYKKIAJKD-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H34N4O6/c1-4-35-23-13-11-20(17-24(23)36-5-2)27-25(31)18-28(3)26(32)19-10-12-21(22(16-19)30(33)34)29-14-8-6-7-9-15-29/h10-13,16-17H,4-9,14-15,18H2,1-3H3,(H,27,31)
PubChem CID4858444
ChEMBLCHEMBL1705416
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
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GLASS IDNameUniProtGeneSpeciesLength
1577Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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