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BDBM113797 2-(4-(Trifluoromethyl)phenyl)-2-(6-(trifluoromethyl) pyridin-2-yl)acetonitrile (29)

SMILES: FC(F)(F)c1ccc(cc1)C(C#N)c1cccc(n1)C(F)(F)F

InChI Key: InChIKey=MAGYXOBGPCOFAY-UHFFFAOYSA-N

Data: 1 IC50

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 = 113797   
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
PvdQ


(Pseudomonas aeruginosa)
BDBM113797
PNG
(2-(4-(Trifluoromethyl)phenyl)-2-(6-(trifluoromethy...)
Show SMILES FC(F)(F)c1ccc(cc1)C(C#N)c1cccc(n1)C(F)(F)F
Show InChI InChI=1S/C15H8F6N2/c16-14(17,18)10-6-4-9(5-7-10)11(8-22)12-2-1-3-13(23-12)15(19,20)21/h1-7,11H
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 140n/an/an/an/an/an/a



The Broad Institute , Cambridge, Massachusetts 02142, United States



Assay Description
The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro...


ACS Chem Biol 9: 1536-44 (2014)


Article DOI: 10.1021/cb5001586
BindingDB Entry DOI: 10.7270/Q2PC311M
More data for this
Ligand-Target Pair