BDBM50305776 1-(4-(2-((3aR,6aS)-5-(4,6-dimethylpyrimidine-5-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)ethyl)-4-(3-fluorophenyl)piperidin-1-yl)-2-methylpropan-1-one::CHEMBL596299

SMILES CC(C)C(=O)N1CCC(CCN2C[C@H]3CN(C[C@H]3C2)C(=O)c2c(C)ncnc2C)(CC1)c1cccc(F)c1

InChI Key InChIKey=XNXHMAJWAVMLJC-UHFFFAOYSA-N

Data  2 IC50

  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 2 hits for monomerid = 50305776   

TargetC-C chemokine receptor type 5(Human)
Roche Palo Alto

Curated by ChEMBL
LigandPNGBDBM50305776(1-(4-(2-((3aR,6aS)-5-(4,6-dimethylpyrimidine-5-car...)
Affinity DataIC50: 102nMAssay Description:Antagonist activity at human CCR5More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2010
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Roche Palo Alto

Curated by ChEMBL
LigandPNGBDBM50305776(1-(4-(2-((3aR,6aS)-5-(4,6-dimethylpyrimidine-5-car...)
Affinity DataIC50: 160nMAssay Description:Antagonist activity at human recombinant CCR5 by cell-cell fusion assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2010
Entry Details Article
PubMed