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Ligand

NameSCHEMBL16465387
Molecular formulaC24H23FN6O2
IUPAC name[4,5-dimethyl-2-(triazol-2-yl)phenyl]-[(2S)-2-[5-(3-fluoro-2-methylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-1-yl]methanone
Molecular weight446.486
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.5
SynonymsUS9493446, 339
BDBM257870
Inchi KeyAKMDANQXWMVNEY-FQEVSTJZSA-N
Inchi IDInChI=1S/C24H23FN6O2/c1-14-12-18(21(13-15(14)2)31-26-9-10-27-31)24(32)30-11-5-8-20(30)22-28-23(33-29-22)17-6-4-7-19(25)16(17)3/h4,6-7,9-10,12-13,20H,5,8,11H2,1-3H3/t20-/m0/s1
PubChem CID117872331
ChEMBLN/A
IUPHARN/A
BindingDB257870
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
536170Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
536169Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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