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Ligand

NameCHEMBL3936595
Molecular formulaC20H23N3O3
IUPAC name1-(2,3-dihydroindol-1-yl)-2-[(2S)-2-(pyridin-3-yloxymethyl)morpholin-4-yl]ethanone
Molecular weight353.422
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP1.7
SynonymsUS9079895, 21s
BDBM186930
SCHEMBL14062013
US9079895, 20s
Inchi KeyXYHRHHHLNLGIRG-SFHVURJKSA-N
Inchi IDInChI=1S/C20H23N3O3/c24-20(23-9-7-16-4-1-2-6-19(16)23)14-22-10-11-25-18(13-22)15-26-17-5-3-8-21-12-17/h1-6,8,12,18H,7,9-11,13-15H2/t18-/m0/s1
PubChem CID71062889
ChEMBLCHEMBL3936595
IUPHARN/A
BindingDB186930
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: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5468575-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421
5468515-hydroxytryptamine receptor 2AP35363Htr2aMus musculus (Mouse)471
5468525-hydroxytryptamine receptor 2BQ02152Htr2bMus musculus (Mouse)479
546853D(1A) dopamine receptorQ61616Drd1Mus musculus (Mouse)446
546854D(1B) dopamine receptorQ8BLD9Drd5Mus musculus (Mouse)478
546858D(2) dopamine receptorP61168Drd2Mus musculus (Mouse)444
546855D(3) dopamine receptorP30728Drd3Mus musculus (Mouse)446
546856D(4) dopamine receptorP51436Drd4Mus musculus (Mouse)387

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