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Ligand

NameCHEMBL49620
Molecular formulaC25H28N2O5
IUPAC name2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]-N-phenylacetamide
Molecular weight436.508
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.1
SynonymsSCHEMBL10346739
Inchi KeyCLXQYPDPCUQTLM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H28N2O5/c28-21(18-31-22-9-5-2-6-10-22)17-26-15-16-30-23-11-13-24(14-12-23)32-19-25(29)27-20-7-3-1-4-8-20/h1-14,21,26,28H,15-19H2,(H,27,29)
PubChem CID15174959
ChEMBLCHEMBL49620
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
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GLASS IDNameUniProtGeneSpeciesLength
45088Beta-3 adrenergic receptorP26255Adrb3Rattus norvegicus (Rat)400

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