BDBM50342518 (Z)-3-(4-((1-(4-(3-(5-Amino-2-(furan-2-yl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl)propyl)phenoxy)-2,10,17-trioxo-3,6,9,16-tetraazaoctadecan-18-yl)oxy)styryl)-5,5-difluoro-8-(1Hpyrrol-2-yl)-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide::CHEMBL1770170

SMILES Nc1nc2n(CCCc3ccc(OCC(=O)NCCNCCNC(=O)CCCCCNC(=O)COc4ccc([CH+]\C=c5\ccc6=Cc7ccc(-c8ccc[nH]8)n7[B-](F)(F)n56)cc4)cc3)ncc2c2nc(nn12)-c1ccco1

InChI Key InChIKey=ZSQQAMPWXALWKR-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50342518   

TargetAdenosine receptor A2a(Human)
National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL
LigandPNGBDBM50342518((Z)-3-(4-((1-(4-(3-(5-Amino-2-(furan-2-yl)-7H-pyra...)
Affinity DataKi:  15.1nMAssay Description:Displacement of [3H]CGS21680 from human recombinant adenosine A2A receptor expressed in HEK293 cells after 60 mins by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2011
Entry Details Article
PubMed