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Ligand

NameCHEMBL50539
Molecular formulaC22H29NO6
IUPAC namepropan-2-yl 2-[4-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethoxy]phenoxy]acetate
Molecular weight403.475
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.9
SynonymsN/A
Inchi KeyFSFCSSRFPOSMBJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H29NO6/c1-17(2)29-22(25)16-28-21-10-8-20(9-11-21)26-13-12-23-14-18(24)15-27-19-6-4-3-5-7-19/h3-11,17-18,23-24H,12-16H2,1-2H3
PubChem CID15034354
ChEMBLCHEMBL50539
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
86015Beta-3 adrenergic receptorP26255Adrb3Rattus norvegicus (Rat)400

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