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Ligand

NameCHEMBL2153551
Molecular formulaC19H23NO6
IUPAC name(3S)-3-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-5-ol
Molecular weight361.394
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.5
SynonymsBDBM50392639
CHEMBL2221145
Inchi KeyCQDKZYPQPMHYAR-ZDUSSCGKSA-N
Inchi IDInChI=1S/C19H23NO6/c1-22-15-6-4-7-16(23-2)19(15)24-10-9-20-11-13-12-25-17-8-3-5-14(21)18(17)26-13/h3-8,13,20-21H,9-12H2,1-2H3/t13-/m0/s1
PubChem CID71454865
ChEMBLN/A
IUPHARN/A
BindingDB50392639
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
479575-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
47952Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
47958Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
47954Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
47956Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
47953Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
47955Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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