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Ligand

NameCHEMBL466713
Molecular formulaC23H26N4O3
IUPAC nameN-[4-[2-[[(2S)-2-hydroxy-3-pyridin-3-yloxypropyl]amino]ethyl]phenyl]-2-pyridin-2-ylacetamide
Molecular weight406.486
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP1.5
SynonymsBDBM50259166
(S)-4''-(2-{[2-Hydroxy-3-(2-benzimidazolon-4-yloxy)-propyl]amino}ethyl)-2-(2-pyridyl)-acetanilide
Inchi KeyAQJCLQHNMBRSSX-NRFANRHFSA-N
Inchi IDInChI=1S/C23H26N4O3/c28-21(17-30-22-5-3-11-24-16-22)15-25-13-10-18-6-8-19(9-7-18)27-23(29)14-20-4-1-2-12-26-20/h1-9,11-12,16,21,25,28H,10,13-15,17H2,(H,27,29)/t21-/m0/s1
PubChem CID44574687
ChEMBLCHEMBL466713
IUPHARN/A
BindingDB50259166
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
11817Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
11819Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
11818Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408

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