BDBM44300 MLS-0412061.0001::cid_44182173::formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[2-oxo-2-(2-phenylhydrazinyl)ethyl]azepan-3-yl]propanamide::formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[2-oxo-2-(phenylhydrazo)ethyl]-3-azepanyl]propanamide::formic acid;(2S)-N-[(3S)-2-keto-1-[2-keto-2-(N'-phenylhydrazino)ethyl]azepan-3-yl]-2-(methylamino)propionamide::methanoic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxidanylidene-1-[2-oxidanylidene-2-(2-phenylhydrazinyl)ethyl]azepan-3-yl]propanamide

SMILES CN[C@@H](C)C(=O)N[C@H]1CCCCN(CC(=O)NNc2ccccc2)C1=O

InChI Key InChIKey=MQVBELLYQQEDIQ-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 = 44300   

TargetE3 ubiquitin-protein ligase XIAP(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 44300BDBM44300(formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[...)
Affinity DataIC50: 9.77E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/25/2011
Entry Details
PCBioAssay
TargetE3 ubiquitin-protein ligase XIAP(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 44300BDBM44300(formic acid;(2S)-2-(methylamino)-N-[(3S)-2-oxo-1-[...)
Affinity DataIC50: 1.14E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/25/2011
Entry Details
PCBioAssay