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Ligand

NameMLS000948134
Molecular formulaC21H22N4OS
IUPAC nameN-(4-methylphenyl)-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanylacetamide
Molecular weight378.494
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.3
SynonymsCHEMBL1516092
MolPort-007-572-355
HMS2240L17
ZINC6721215
AKOS001720592
[ Show all ]
Inchi KeyABSRNJFQSFSUAP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N4OS/c1-15-8-10-16(11-9-15)22-19(26)14-27-21-20(25-12-4-5-13-25)23-17-6-2-3-7-18(17)24-21/h2-3,6-11H,4-5,12-14H2,1H3,(H,22,26)
PubChem CID22332560
ChEMBLCHEMBL1516092
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
1150Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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