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Ligand

NameCHEMBL543717
Molecular formulaC20H30N2O3
IUPAC name3-[[3-[4-[2-(cyclobutylmethoxy)ethyl]phenoxy]-2-hydroxypropyl]amino]butanenitrile
Molecular weight346.471
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.7
SynonymsBDBM50405517
SCHEMBL11246358
CHEMBL1192477
Inchi KeyGQBZOBXTYCGAGK-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H30N2O3/c1-16(9-11-21)22-13-19(23)15-25-20-7-5-17(6-8-20)10-12-24-14-18-3-2-4-18/h5-8,16,18-19,22-23H,2-4,9-10,12-15H2,1H3
PubChem CID44264298
ChEMBLN/A
IUPHARN/A
BindingDB50405517
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
102493Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466

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