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Ligand

NameCHEMBL3663554
Molecular formulaC23H19BrFN7O
IUPAC name[2-[(3-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-7-azabicyclo[2.2.1]heptan-7-yl]-(3-fluoro-2-pyrimidin-2-ylphenyl)methanone
Molecular weight508.355
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM164140
US9475819, 270
BDBM255252
SCHEMBL16081384
US9062078, 270
Inchi KeyBNPVELSULLCXLP-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H19BrFN7O/c24-18-12-29-22-21(28-9-10-31(18)22)30-16-11-13-5-6-17(16)32(13)23(33)14-3-1-4-15(25)19(14)20-26-7-2-8-27-20/h1-4,7-10,12-13,16-17H,5-6,11H2,(H,28,30)
PubChem CID90445387
ChEMBLCHEMBL3663554
IUPHARN/A
BindingDB164140
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
517464Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
466383Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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