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Ligand

NameMLS002155828
Molecular formulaC23H29N3O4S
IUPAC nameN-[4-(azepan-1-yl)phenyl]-3-morpholin-4-ylsulfonylbenzamide
Molecular weight443.562
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.9
SynonymsCHEMBL1436869
MolPort-003-322-836
HMS3046N14
ZINC9463517
AKOS001291023
[ Show all ]
Inchi KeyACIJJUBPBLBXBP-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H29N3O4S/c27-23(24-20-8-10-21(11-9-20)25-12-3-1-2-4-13-25)19-6-5-7-22(18-19)31(28,29)26-14-16-30-17-15-26/h5-11,18H,1-4,12-17H2,(H,24,27)
PubChem CID16307678
ChEMBLCHEMBL1436869
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
1607Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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