BDBM50310772 CHEMBL1080417::N-[(S)-2-(thiazol-5-ylmethoxycarbonylamino)propyl]-N-[(R)-2-(thiazol-5-ylmethoxycarbonylamino)propyl]ethylamine

SMILES CCN(C[C@H](C)NC(=O)OCc1cncs1)C[C@@H](C)NC(=O)OCc1nccs1

InChI Key InChIKey=QURAXYQDHTYNMN-UHFFFAOYSA-N

Data  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 1 hit for monomerid = 50310772   

TargetCytochrome P450 3A4(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50310772(N-[(S)-2-(thiazol-5-ylmethoxycarbonylamino)propyl]...)
Affinity DataIC50: 1.79E+3nMAssay Description:Inhibition of human recombinant CYP3A4-mediated oxidation of 7-benzyloxyquinolineMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/17/2010
Entry Details Article
PubMed