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Ligand

NameCHEMBL243002
Molecular formulaC20H26N2O
IUPAC nameN-[[1-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)cyclohexyl]methyl]acetamide
Molecular weight310.441
Hydrogen bond acceptor1
Hydrogen bond donor1
XlogP3.8
SynonymsBDBM50423056
Inchi KeyYIGCYAJXYJBOOS-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H26N2O/c1-15(23)21-14-20(10-3-2-4-11-20)18-13-22-12-6-8-16-7-5-9-17(18)19(16)22/h5,7,9,13H,2-4,6,8,10-12,14H2,1H3,(H,21,23)
PubChem CID16743464
ChEMBLCHEMBL243002
IUPHARN/A
BindingDB50423056
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
410782Melatonin receptor type 1AP48039MTNR1AHomo sapiens (Human)350
410781Melatonin receptor type 1BP49286MTNR1BHomo sapiens (Human)362
410780Melatonin receptor type 1CP49219mtnr1cXenopus laevis (African clawed frog)420

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