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Ligand

NameCHEMBL2153559
Molecular formulaC20H25NO6
IUPAC name2-(2,6-dimethoxyphenoxy)-N-[[(2S)-5-methoxy-2,3-dihydro-1,4-benzodioxin-2-yl]methyl]ethanamine
Molecular weight375.421
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.9
SynonymsCHEMBL2220898
BDBM50392647
(S)-N-[2-(2,6-Dimethoxyphenoxy)ethyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-2beta-methanamine
Inchi KeyBPBCIZXGJQIHRC-AWEZNQCLSA-N
Inchi IDInChI=1S/C20H25NO6/c1-22-15-6-4-7-16(23-2)19(15)25-11-10-21-12-14-13-26-20-17(24-3)8-5-9-18(20)27-14/h4-9,14,21H,10-13H2,1-3H3/t14-/m0/s1
PubChem CID10621592
ChEMBLN/A
IUPHARN/A
BindingDB50392647
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
293675-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
29365Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
29368Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
29366Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
29370Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
29364Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
29369Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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