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Ligand

NameCHEMBL43405
Molecular formulaC22H30FNO4
IUPAC name1-[4-[2-[2-(4-fluorophenyl)ethoxy]ethoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
Molecular weight391.483
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.7
Synonyms1-(4-(2-(Fluorophenethyloxy)ethyl)phenoxy)-3-isopropylamino-2-propanol hcl
BDBM50406703
RO-31-1118
1-[4-[2-[2-(4-fluorophenyl)ethoxy]ethoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
CTK3E9589
[ Show all ]
Inchi KeyCYCXZGUVPDRYLG-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H30FNO4/c1-17(2)24-15-20(25)16-28-22-9-7-21(8-10-22)27-14-13-26-12-11-18-3-5-19(23)6-4-18/h3-10,17,20,24-25H,11-16H2,1-2H3
PubChem CID135817
ChEMBLCHEMBL43405
IUPHARN/A
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
53368Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
53369Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415

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