BDBM41849 2-[(1R)-1-carboxy-2-(1-methyl-3-indolyl)ethyl]-1,3-dioxo-5-isoindolecarboxylic acid::2-[(1R)-1-carboxy-2-(1-methylindol-3-yl)ethyl]-1,3-diketo-isoindoline-5-carboxylic acid::2-[(1R)-1-carboxy-2-(1-methylindol-3-yl)ethyl]-1,3-dioxoisoindole-5-carboxylic acid::2-[(2R)-3-(1-methylindol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid::NCGC00161788-01::cid_16752638

SMILES Cn1cc(C[C@@H](N2C(=O)c3ccc(cc3C2=O)C(O)=O)C(O)=O)c2ccccc12

InChI Key InChIKey=RRZZQDKNPVPQGW-QGZVFWFLSA-N

Data  1 KI

  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 1 hit for monomerid = 41849   

TargetBeta-lactamase(Escherichia coli)
Ncgc

Curated by PubChem BioAssay
LigandPNGBDBM41849(2-[(1R)-1-carboxy-2-(1-methyl-3-indolyl)ethyl]-1,3...)
Affinity DataKi:  1.70E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] NIH Chemical Genomics Center [NCGC] MLSCN Grant: MH079825-01 Assay Provider: Shoichet, Bria...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay