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Ligand

NameCHEMBL551350
Molecular formulaC26H30N2O5
IUPAC nameN-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]-2-(4-methoxyphenyl)acetamide
Molecular weight450.535
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP3.2
SynonymsBDBM50293422
(S)-4''-(2-{[2-Hydroxy-3-(4-hydroxyphenoxy)propyl]amino}ethyl)-2-(4-methoxyphenyl)acetanilide
Inchi KeyAQLXCWUWNRWFSB-QHCPKHFHSA-N
Inchi IDInChI=1S/C26H30N2O5/c1-32-24-10-4-20(5-11-24)16-26(31)28-21-6-2-19(3-7-21)14-15-27-17-23(30)18-33-25-12-8-22(29)9-13-25/h2-13,23,27,29-30H,14-18H2,1H3,(H,28,31)/t23-/m0/s1
PubChem CID44127054
ChEMBLCHEMBL551350
IUPHARN/A
BindingDB50293422
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11892Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
11890Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
11891Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408

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