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Ligand

NameCHEMBL287587
Molecular formulaC8H10FNO3
IUPAC name4-(2-amino-1-hydroxyethyl)-3-fluorobenzene-1,2-diol
Molecular weight187.17
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP-0.5
SynonymsBenzenethanamine, 2-fluoro-.beta.,3,4-trihydroxy-
4-(2-Amino-1-hydroxy-ethyl)-3-fluoro-benzene-1,2-diol
FOTRTWXNJQSQJS-UHFFFAOYSA-N
1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-3-fluoro-
4-(2-amino-1-hydroxyethyl)-3-fluorobenzene-1,2-diol
[ Show all ]
Inchi KeyFOTRTWXNJQSQJS-UHFFFAOYSA-N
Inchi IDInChI=1S/C8H10FNO3/c9-7-4(6(12)3-10)1-2-5(11)8(7)13/h1-2,6,11-13H,3,10H2
PubChem CID172745
ChEMBLCHEMBL287587
IUPHARN/A
BindingDB50019060
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83605Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
83603Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
83601Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
83600Beta-2 adrenergic receptorP10608Adrb2Rattus norvegicus (Rat)418
83602Beta-2 adrenergic receptorP54833ADRB2Canis lupus familiaris (Dog)415
83604Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413

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