BDBM50221112 1-((R)-3-(2,4-dichlorophenyl)-1-(4-(4-fluoro-2-((S)-3-methyl-1-(2-(methylamino)ethylamino)butyl)phenyl)piperazin-1-yl)-1-oxopropan-2-yl)pyrrolidin-2-one::CHEMBL237577

SMILES CNCCN[C@@H](CC(C)C)c1cc(F)ccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1Cl)N1CCCC1=O

InChI Key InChIKey=XXHJASVEYUQRFO-UHFFFAOYSA-N

Data  1 KI  1 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 = 50221112   

TargetCytochrome P450 3A4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50221112(1-((R)-3-(2,4-dichlorophenyl)-1-(4-(4-fluoro-2-((S...)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of microsomal CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMelanocortin receptor 4(Human)
Neurocrine Biosciences

Curated by ChEMBL
LigandPNGBDBM50221112(1-((R)-3-(2,4-dichlorophenyl)-1-(4-(4-fluoro-2-((S...)
Affinity DataKi:  49nMAssay Description:Binding affinity at human MC4RMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed