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Ligand

NameCHEMBL3663573
Molecular formulaC24H25F3N6O2
IUPAC name[2-(2,4-dimethylpyrazol-3-yl)-6-methoxyphenyl]-[2-[[5-(trifluoromethyl)pyrazin-2-yl]amino]-7-azabicyclo[2.2.1]heptan-7-yl]methanone
Molecular weight486.499
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM164162
SCHEMBL16081368
US9062078, 292
Inchi KeyFQGVMFCTXQTZLC-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H25F3N6O2/c1-13-10-30-32(2)22(13)15-5-4-6-18(35-3)21(15)23(34)33-14-7-8-17(33)16(9-14)31-20-12-28-19(11-29-20)24(25,26)27/h4-6,10-12,14,16-17H,7-9H2,1-3H3,(H,29,31)
PubChem CID90445371
ChEMBLCHEMBL3663573
IUPHARN/A
BindingDB164162
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
517744Orexin receptor type 1P56718Hcrtr1Rattus norvegicus (Rat)416
473350Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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