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BDBM50351516 CHEMBL1823953

SMILES: Clc1ccc(OCCCC(=O)NC2CCOC2=O)cc1

InChI Key: InChIKey=BKVYYPQMGSVOHB-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50351516   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50351516
PNG
(CHEMBL1823953)
Show SMILES Clc1ccc(OCCCC(=O)NC2CCOC2=O)cc1
Show InChI InChI=1S/C14H16ClNO4/c15-10-3-5-11(6-4-10)19-8-1-2-13(17)16-12-7-9-20-14(12)18/h3-6,12H,1-2,7-9H2,(H,16,17)
PDB
MMDB

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
PDB
UniChem

Patents

PDB
Article
PubMed
n/an/a 377n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Chromobacterium violaceum CviR-dependent GFP fluorescence in Escherichia coli


J Med Chem 53: 7467-89 (2010)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)