Reaction Details Report a problem with these data
Target
Beta-lactamase
Ligand
BDBM66145
Substrate
n/a
Meas. Tech.
Epi-absorbance-based dose response assay for common IMP-1 and VIM-2 inhibitors: biochemical high throughput counterscreen to identify inhibitors of TEM-1 metallo-beta-lactamase
IC50
>59640±n/a nM
Citation
 PubChem, PC Epi-absorbance-based dose response assay for common IMP-1 and VIM-2 inhibitors: biochemical high throughput counterscreen to identify inhibitors of TEM-1 metallo-beta-lactamase PubChem Bioassay (2010)[AID] 
Target
Name:
Beta-lactamase
Synonyms:
n/a
Type:
Enzyme Catalytic Domain
Mol. Mass.:
29494.42
Organism:
Salmonella enterica subsp. enterica serovar Choleraesuis str. SC-B67
Description:
gi_60115532
Residue:
269
Sequence:
MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDQLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTDGESGNYG
  
Inhibitor
Name:
BDBM66145
Synonyms:
MLS000948311 | N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide | N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]tetrahydrofuran-2-carboxamide | N-[4-[oxo-[4-(trifluoromethyl)anilino]methyl]phenyl]-2-oxolanecarboxamide | SMR000621339 | cid_15994190
Type:
Small organic molecule
Emp. Form.:
C19H17F3N2O3
Mol. Mass.:
378.3451
SMILES:
FC(F)(F)c1ccc(NC(=O)c2ccc(NC(=O)C3CCCO3)cc2)cc1
Structure:
Search PDB for entries with ligand similarity: