BDBM44320 (2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]-2-(methylamino)propionamide;formic acid::(2S)-N-[(2S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-(methylamino)propanamide;formic acid::(2S)-N-[(2S)-1-[(2S)-2-[[(3-fluorophenyl)amino]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-(methylamino)propanamide;methanoic acid::(2S)-N-[(2S)-1-[(2S)-2-[[(3-fluorophenyl)hydrazo]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]-2-(methylamino)propanamide;formic acid::MLS-0412155.0001::cid_44182227

SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)NNc1cccc(F)c1

InChI Key InChIKey=DTFXFUTUIMILNU-JQFCIGGWSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 44320   

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

Curated by PubChem BioAssay
LigandPNGBDBM44320((2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl...)
Affinity DataIC50:  6.50E+3nMAssay 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 DepthDetails PCBioAssay
TargetE3 ubiquitin-protein ligase XIAP(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44320((2S)-N-[(1S)-1-[(2S)-2-[(3-fluoroanilino)carbamoyl...)
Affinity DataIC50:  2.70E+3nMAssay 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 DepthDetails PCBioAssay