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Ligand

NameCHEMBL126347
Molecular formulaC9H11F2NO3
IUPAC name3,6-difluoro-4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
Molecular weight219.188
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogP0.1
SynonymsBDBM50042999
3,6-Difluoro-4-[1-hydroxy-2-(methylamino)ethyl]-1,2-benzenediol #
AC1LBSVC
Benzeneethanamine, 2,5-difluoro-.beta.,3,4-trihydroxy-N-methyl-
3,6-difluoro-4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
[ Show all ]
Inchi KeyKCSBHJHUGQEHSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H11F2NO3/c1-12-3-6(13)4-2-5(10)8(14)9(15)7(4)11/h2,6,12-15H,3H2,1H3
PubChem CID541614
ChEMBLCHEMBL126347
IUPHARN/A
BindingDB50042999
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
166018Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
166019Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418

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