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Ligand

NameCHEMBL3979116
Molecular formulaC21H24N2O3
IUPAC name1-(2,3-dihydroindol-1-yl)-2-[(2S)-2-(phenoxymethyl)morpholin-4-yl]ethanone
Molecular weight352.434
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.7
SynonymsSCHEMBL14061558
US9079895, 18s
BDBM186926
QTIAESZAMKLZSK-IBGZPJMESA-N
(S)-1-(Indolin-1-yl)-2-(2-(phenoxymethyl)morpholino)ethanone
Inchi KeyQTIAESZAMKLZSK-IBGZPJMESA-N
Inchi IDInChI=1S/C21H24N2O3/c24-21(23-11-10-17-6-4-5-9-20(17)23)15-22-12-13-25-19(14-22)16-26-18-7-2-1-3-8-18/h1-9,19H,10-16H2/t19-/m0/s1
PubChem CID71062560
ChEMBLCHEMBL3979116
IUPHARN/A
BindingDB186926
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5437265-hydroxytryptamine receptor 2BQ02152Htr2bMus musculus (Mouse)479
543727D(4) dopamine receptorP51436Drd4Mus musculus (Mouse)387

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