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Ligand

NameAC1MLG45
Molecular formulaC21H27FN4O2S
IUPAC nameN-[2-(cyclopentylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(3-methylbutyl)thiadiazole-4-carboxamide
Molecular weight418.531
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.3
SynonymsMLS000999850
CHEMBL1727214
HMS2922C03
AKOS000709155
ASN 06291537
[ Show all ]
Inchi KeyAHUHIPAOEJGUBL-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H27FN4O2S/c1-14(2)11-12-26(21(28)18-13-29-25-24-18)19(15-7-9-16(22)10-8-15)20(27)23-17-5-3-4-6-17/h7-10,13-14,17,19H,3-6,11-12H2,1-2H3,(H,23,27)
PubChem CID3219341
ChEMBLCHEMBL1727214
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
5891Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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