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BDBM50363851 CHEMBL1945938

SMILES: Fc1cc2[nH]cc(-c3nc4ccccc4nc3Cl)c2cc1F

InChI Key: InChIKey=FFXWDDMBUMVVFL-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50363851   
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
Chorismate mutase (MTB CM)


(Mycobacterium tuberculosis H37Rv)
BDBM50363851
PNG
(CHEMBL1945938)
Show SMILES Fc1cc2[nH]cc(-c3nc4ccccc4nc3Cl)c2cc1F
Show InChI InChI=1S/C16H8ClF2N3/c17-16-15(21-12-3-1-2-4-13(12)22-16)9-7-20-14-6-11(19)10(18)5-8(9)14/h1-7,20H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.97E+4n/an/an/an/an/an/a



University of Hyderabad Campus

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis chorismate mutase expressed in Escherichia coli BL21 assessed as conversion of chorismate to prephenate afte...


Bioorg Med Chem 20: 1711-22 (2012)


Article DOI: 10.1016/j.bmc.2012.01.012
BindingDB Entry DOI: 10.7270/Q2222V6Q
More data for this
Ligand-Target Pair