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BDBM70199 2-(3,4-dimethylphenoxy)-N-[2-[3-(trifluoromethyl)phenyl]-5-benzotriazolyl]acetamide::2-(3,4-dimethylphenoxy)-N-[2-[3-(trifluoromethyl)phenyl]benzotriazol-5-yl]acetamide::2-(3,4-dimethylphenoxy)-N-[2-[3-(trifluoromethyl)phenyl]benzotriazol-5-yl]ethanamide::SR-01000528153::SR-01000528153-2::cid_1114257

SMILES: Cc1ccc(OCC(=O)Nc2ccc3nn(nc3c2)-c2cccc(c2)C(F)(F)F)cc1C

InChI Key: InChIKey=LLGHJTGOZDACAA-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 70199   
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
Kruppel-like factor 5


(Homo sapiens (Human))
BDBM70199
PNG
(2-(3,4-dimethylphenoxy)-N-[2-[3-(trifluoromethyl)p...)
Show SMILES Cc1ccc(OCC(=O)Nc2ccc3nn(nc3c2)-c2cccc(c2)C(F)(F)F)cc1C
Show InChI InChI=1S/C23H19F3N4O2/c1-14-6-8-19(10-15(14)2)32-13-22(31)27-17-7-9-20-21(12-17)29-30(28-20)18-5-3-4-16(11-18)23(24,25)26/h3-12H,13H2,1-2H3,(H,27,31)
PDB
MMDB

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PC cid
PC sid
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n/an/a>3.98E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2010)

More data for this
Ligand-Target Pair