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Ligand

NameSMR000628379
Molecular formulaC25H31N3O4S
IUPAC name1-[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonyl]-N-(3-ethylphenyl)piperidine-4-carboxamide
Molecular weight469.6
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.0
SynonymsAKOS021731416
MolPort-007-742-755
HMS2256P07
1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-(3-ethylphenyl)piperidine-4-carboxamide
MLS001122736
[ Show all ]
Inchi KeyAFLURBNFSGNBNT-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H31N3O4S/c1-4-19-6-5-7-22(15-19)26-25(30)20-10-12-27(13-11-20)33(31,32)23-8-9-24-21(16-23)14-17(2)28(24)18(3)29/h5-9,15-17,20H,4,10-14H2,1-3H3,(H,26,30)
PubChem CID20901923
ChEMBLCHEMBL1396779
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
463409Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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