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Ligand

NameCHEMBL3659242
Molecular formulaC24H22N6O2
IUPAC name[2-(pyridin-2-yloxymethyl)-7-azabicyclo[2.2.1]heptan-7-yl]-[3-(triazol-2-yl)quinolin-2-yl]methanone
Molecular weight426.48
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.9
SynonymsUS9062078, 74
BDBM163943
SCHEMBL16041094
Inchi KeyAYJHDWGNHNBJBV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22N6O2/c31-24(23-21(30-26-11-12-27-30)14-16-5-1-2-6-19(16)28-23)29-18-8-9-20(29)17(13-18)15-32-22-7-3-4-10-25-22/h1-7,10-12,14,17-18,20H,8-9,13,15H2
PubChem CID90412558
ChEMBLCHEMBL3659242
IUPHARN/A
BindingDB163943
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
517415Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
465024Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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