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Ligand

NameCHEMBL3930835
Molecular formulaC15H25NO3
IUPAC name5-[(1R)-2-[[(2S)-heptan-2-yl]amino]-1-hydroxyethyl]benzene-1,3-diol
Molecular weight267.369
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP2.7
SynonymsBDBM206776
US9492405, (R,S)-6
(R,S)-6
Inchi KeyDFGXCGQPCWUBML-NHYWBVRUSA-N
Inchi IDInChI=1S/C15H25NO3/c1-3-4-5-6-11(2)16-10-15(19)12-7-13(17)9-14(18)8-12/h7-9,11,15-19H,3-6,10H2,1-2H3/t11-,15-/m0/s1
PubChem CID16735774
ChEMBLCHEMBL3930835
IUPHARN/A
BindingDB206776
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
537423Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
537424Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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