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Ligand

NameOrexin receptor antagonist 15
Molecular formulaC21H19BrN6O2
IUPAC name2-[(3R,6R)-1-[5-bromo-2-(triazol-2-yl)benzoyl]-6-methylpiperidin-3-yl]oxypyridine-4-carbonitrile
Molecular weight467.327
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.7
SynonymsUS20130102619, 15
BDBM97384
SCHEMBL14876716
CHEMBL3642129
Inchi KeyVSEQFHTWFOJAHR-RHSMWYFYSA-N
Inchi IDInChI=1S/C21H19BrN6O2/c1-14-2-4-17(30-20-10-15(12-23)6-7-24-20)13-27(14)21(29)18-11-16(22)3-5-19(18)28-25-8-9-26-28/h3,5-11,14,17H,2,4,13H2,1H3/t14-,17-/m1/s1
PubChem CID71526391
ChEMBLCHEMBL3642129
IUPHARN/A
BindingDB97384
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
362949Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
362952Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
362950Orexin receptor type 2P56719Hcrtr2Rattus norvegicus (Rat)460
362951Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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