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Ligand

NameN6-2-(4-Aminophenyl)ethyladenosine
Molecular formulaC18H22N6O4
IUPAC name2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight386.412
Hydrogen bond acceptor9
Hydrogen bond donor5
XlogP0.9
SynonymsAC1L1I2P
D0A8EK
LP00118
NCGC00093612-02
[3H]N6-2-(4-Aminophenyl)ethyladenosine
[ Show all ]
Inchi KeyXTPOZVLRZZIEBW-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H22N6O4/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(27)14(26)12(7-25)28-18/h1-4,8-9,12,14-15,18,25-27H,5-7,19H2,(H,20,21,22)
PubChem CID4397
ChEMBLCHEMBL326958
IUPHAR417, 462
BindingDB50037785
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
400603Adenosine receptor A1P34970ADORA1Oryctolagus cuniculus (Rabbit)328
555278Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
400602Adenosine receptor A3O02667ADORA3Oryctolagus cuniculus (Rabbit)319
555279Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
400606D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
400607Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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