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Ligand

NameCHEMBL3398471
Molecular formulaC21H20FN7O2
IUPAC nameN-ethyl-N-[2-[5-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-3-yl]ethyl]-5-methyl-2-(triazol-2-yl)benzamide
Molecular weight421.436
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.0
SynonymsN-Ethyl-N-{2-[5-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-3-yl]ethyl}-5-methyl-2-(2H-1,2,3-triazol-2-yl)benzamide
SCHEMBL13833377
AJUIDXGPKBVVMP-UHFFFAOYSA-N
Inchi KeyAJUIDXGPKBVVMP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20FN7O2/c1-3-28(11-8-19-26-20(31-27-19)17-6-5-15(22)13-23-17)21(30)16-12-14(2)4-7-18(16)29-24-9-10-25-29/h4-7,9-10,12-13H,3,8,11H2,1-2H3
PubChem CID71007308
ChEMBLCHEMBL3398471
IUPHARN/A
BindingDBN/A
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
441989Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
441988Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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