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Ligand

NameCHEMBL31772
Molecular formulaC14H21NO4
IUPAC nameethyl 3-[(2-hydroxy-3-phenoxypropyl)amino]propanoate
Molecular weight267.325
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP1.0
SynonymsAKOS011231508
BDBM50404751
Inchi KeyBGDSCKIMCCCOPQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H21NO4/c1-2-18-14(17)8-9-15-10-12(16)11-19-13-6-4-3-5-7-13/h3-7,12,15-16H,2,8-11H2,1H3
PubChem CID15578573
ChEMBLCHEMBL31772
IUPHARN/A
BindingDB50404751
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
22882Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418

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