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Ligand

NameCHEMBL6898
Molecular formulaC13H19NO3
IUPAC name(1R)-2-(propan-2-ylamino)-1,2,3,4-tetrahydronaphthalene-1,6,7-triol
Molecular weight237.299
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP1.2
SynonymsBDBM50000501
2-Isopropylamino-1,2,3,4-tetrahydro-naphthalene-1,6,7-triol
Inchi KeyOCSSSNKRNYLNAI-JLOHTSLTSA-N
Inchi IDInChI=1S/C13H19NO3/c1-7(2)14-10-4-3-8-5-11(15)12(16)6-9(8)13(10)17/h5-7,10,13-17H,3-4H2,1-2H3/t10?,13-/m1/s1
PubChem CID44263964
ChEMBLCHEMBL6898
IUPHARN/A
BindingDB50000501
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
238004Beta-1 adrenergic receptorP18090Adrb1Rattus norvegicus (Rat)466
238003Beta-2 adrenergic receptorQ8K4Z4Adrb2Cavia porcellus (Guinea pig)418
238005Beta-2 adrenergic receptorQ28044ADRB2Bos taurus (Bovine)418

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