BDBM21118 (2S)-2-amino-3-(4-hydroxyphenyl)-N-[(1R)-1-({2-oxo-2-[4-(N-phenylpropanamido)piperidin-1-yl]ethyl}carbamoyl)ethyl]propanamide::4-anilidopiperidine, 13

SMILES CCC(=O)N(C1CCN(CC1)C(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)c1ccccc1

InChI Key InChIKey=LJHNFIDTQZUSFK-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 21118   

TargetMu-type opioid receptor(Rat)
University of Arizona Tucson

LigandPNGBDBM21118((2S)-2-amino-3-(4-hydroxyphenyl)-N-[(1R)-1-({2-oxo...)
Affinity DataKi:  5.70E+3nM ΔG°:  -7.15kcal/molepH: 7.4 T: 2°CAssay Description:Log IC50 values for each test compound were determined from nonlinear regression analysis of data collected from two independent experiments performe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2008
Entry Details Article
PubMed
TargetDelta-type opioid receptor(Human)
University of Arizona Tucson

LigandPNGBDBM21118((2S)-2-amino-3-(4-hydroxyphenyl)-N-[(1R)-1-({2-oxo...)
Affinity DataKi:  7.00E+3nM ΔG°:  -7.03kcal/molepH: 7.4 T: 2°CAssay Description:Log IC50 values for each test compound were determined from nonlinear regression analysis of data collected from two independent experiments performe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/6/2008
Entry Details Article
PubMed