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Ligand

NameCHEMBL1255003
Molecular formulaC25H29NO3
IUPAC nameN-[2-(2,6-dimethylphenoxy)ethyl]-2-(2-phenylmethoxyphenoxy)ethanamine
Molecular weight391.511
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.3
SynonymsBDBM50416864
Inchi KeyBASQZMOJDHSJPS-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H29NO3/c1-20-9-8-10-21(2)25(20)28-18-16-26-15-17-27-23-13-6-7-14-24(23)29-19-22-11-4-3-5-12-22/h3-14,26H,15-19H2,1-2H3
PubChem CID52947088
ChEMBLCHEMBL1255003
IUPHARN/A
BindingDB50416864
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
191395-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
19138Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
19143Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
19140Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
19144Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
19141Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
19142Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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