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Ligand

NameCHEMBL2234452
Molecular formulaC20H25NO5
IUPAC name(2R,5R)-N-[2-(2,6-dimethoxyphenoxy)ethyl]-5-phenyl-1,4-dioxan-2-amine
Molecular weight359.422
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.6
SynonymsN/A
Inchi KeyAZMXYPJIGNJSOZ-RBUKOAKNSA-N
Inchi IDInChI=1S/C20H25NO5/c1-22-16-9-6-10-17(23-2)20(16)24-12-11-21-19-14-25-18(13-26-19)15-7-4-3-5-8-15/h3-10,18-19,21H,11-14H2,1-2H3/t18-,19+/m0/s1
PubChem CID76322413
ChEMBLCHEMBL2234452
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
18334Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466

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