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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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Ligand

NameSCHEMBL14061894
Molecular formulaC20H23N3O3
IUPAC name1-(2,3-dihydroindol-1-yl)-2-[(2R)-2-(pyridin-2-yloxymethyl)morpholin-4-yl]ethanone
Molecular weight353.422
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.0
Synonyms(R)-1-(Indolin-1-yl)-2-(2-((pyridin-2-yloxy)methyl)morpholino)ethanone
BDBM186922
US9079895, 14r
UYEFMPKULUMHBG-QGZVFWFLSA-N
Inchi KeyUYEFMPKULUMHBG-QGZVFWFLSA-N
Inchi IDInChI=1S/C20H23N3O3/c24-20(23-10-8-16-5-1-2-6-18(16)23)14-22-11-12-25-17(13-22)15-26-19-7-3-4-9-21-19/h1-7,9,17H,8,10-15H2/t17-/m1/s1
PubChem CID71062807
ChEMBLN/A
IUPHARN/A
BindingDB186922
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
5681905-hydroxytryptamine receptor 1AQ64264Htr1aMus musculus (Mouse)421

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