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Ligand

NameCHEMBL1328077
Molecular formulaC24H25N3O2S
IUPAC nameN-[2-(4-methylsulfanylphenyl)ethyl]-4-(4-oxopyrrolo[1,2-a]quinoxalin-5-yl)butanamide
Molecular weight419.543
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.8
SynonymsE228-1471
MolPort-007-729-317
ZINC8588538
HMS1861L15
N-{2-[4-(methylthio)phenyl]ethyl}-4-(4-oxopyrrolo[1,2-a]quinoxalin-5(4H)-yl)butanamide
[ Show all ]
Inchi KeyAEAQKTAUEMPISV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H25N3O2S/c1-30-19-12-10-18(11-13-19)14-15-25-23(28)9-5-17-27-21-7-3-2-6-20(21)26-16-4-8-22(26)24(27)29/h2-4,6-8,10-13,16H,5,9,14-15,17H2,1H3,(H,25,28)
PubChem CID16018192
ChEMBLCHEMBL1328077
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463278Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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