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Ligand

NameCHEMBL394406
Molecular formulaC16H21BrN2O2
IUPAC nameN-[2-(7-bromo-5-methoxy-1-methylindol-3-yl)ethyl]butanamide
Molecular weight353.26
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP3.1
SynonymsN/A
Inchi KeyYBEOAQXDVQZIRF-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H21BrN2O2/c1-4-5-15(20)18-7-6-11-10-19(2)16-13(11)8-12(21-3)9-14(16)17/h8-10H,4-7H2,1-3H3,(H,18,20)
PubChem CID44429451
ChEMBLCHEMBL394406
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
405863Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
405862Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362
405861Melatonin receptor type 1CP49219mtnr1cXenopus laevis (African clawed frog)420

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