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BDBM50436713 BUTENAFINE::Mentax::Mentax-TC

SMILES: CN(Cc1ccc(cc1)C(C)(C)C)Cc1cccc2ccccc12

InChI Key: InChIKey=ABJKWBDEJIDSJZ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436713   
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
Enoyl-[acyl-carrier-protein] reductase [NADH]


(Francisella tularensis subsp. tularensis (strain S...)
BDBM50436713
PNG
(BUTENAFINE | Mentax | Mentax-TC)
Show SMILES CN(Cc1ccc(cc1)C(C)(C)C)Cc1cccc2ccccc12
Show InChI InChI=1S/C23H27N/c1-23(2,3)21-14-12-18(13-15-21)16-24(4)17-20-10-7-9-19-8-5-6-11-22(19)20/h5-15H,16-17H2,1-4H3
PDB
MMDB

KEGG

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DrugBank
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.60E+4n/an/an/an/an/an/a



Naval Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of C-terminal His6-tagged Francisella tularensis SCHU S4 FabI expressed in Escherichia coli BL21 (DE3) using CrCoA as substrate assessed a...


J Med Chem 56: 5275-87 (2014)

More data for this
Ligand-Target Pair