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Ligand

NameCHEMBL290024
Molecular formulaC22H26N2O2
IUPAC name1-(dicyclopropylmethylideneamino)oxy-3-(2-phenylanilino)propan-2-ol
Molecular weight350.462
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.1
SynonymsBDBM50064230
Dicyclopropyl ketone O-[2-hydroxy-3-[(1,1'-biphenyl-2-yl)amino]propyl]oxime
Dicyclopropyl-methanone O-[3-(biphenyl-2-ylamino)-2-hydroxy-propyl]-oxime
Inchi KeyKNCNOSADGGQHIX-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N2O2/c25-19(15-26-24-22(17-10-11-17)18-12-13-18)14-23-21-9-5-4-8-20(21)16-6-2-1-3-7-16/h1-9,17-19,23,25H,10-15H2
PubChem CID10596336
ChEMBLCHEMBL290024
IUPHARN/A
BindingDB50064230
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
173248Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415

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