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Ligand

NameCHEMBL276029
Molecular formulaC25H33N3O5
IUPAC name1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-[4-[5-(2-methoxyethyl)-1H-imidazol-2-yl]phenoxy]propan-2-ol
Molecular weight455.555
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP2.7
SynonymsBDBM50405423
Inchi KeyARYZBTXGQJGWRN-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H33N3O5/c1-30-13-11-20-15-27-25(28-20)19-5-7-22(8-6-19)33-17-21(29)16-26-12-10-18-4-9-23(31-2)24(14-18)32-3/h4-9,14-15,21,26,29H,10-13,16-17H2,1-3H3,(H,27,28)
PubChem CID13621665
ChEMBLCHEMBL276029
IUPHARN/A
BindingDB50405423
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
12920Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418

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