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Ligand

NameAC1LQJ8G
Molecular formulaC19H22F3N5O2S
IUPAC name4-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-oxo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Molecular weight441.473
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.5
SynonymsMLS001142499
CHEMBL1548857
MolPort-000-775-775
MolPort-002-608-910
HMS2934M10
[ Show all ]
Inchi KeyADQUXCDSEMBIKZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H22F3N5O2S/c1-12-3-4-13(2)14(11-12)26-7-9-27(10-8-26)16(29)6-5-15(28)23-18-25-24-17(30-18)19(20,21)22/h3-4,11H,5-10H2,1-2H3,(H,23,25,28)
PubChem CID1401684
ChEMBLCHEMBL1548857
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
2987Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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