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BDBM50427554 3-(3-(Trifluoromethyl)Phenyl)Acrylamide::CHEMBL107281

SMILES: NC(=O)\C=C\c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=VETMUDCRMKPGOI-SNAWJCMRSA-N

Data: 1 Kd

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 = 50427554   
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
Steroid Delta-isomerase


(Pseudomonas putida)
BDBM50427554
PNG
(3-(3-(Trifluoromethyl)Phenyl)Acrylamide | CHEMBL10...)
Show SMILES NC(=O)\C=C\c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C10H8F3NO/c11-10(12,13)8-3-1-2-7(6-8)4-5-9(14)15/h1-6H,(H2,14,15)/b5-4+
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MMDB

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 5.00E+4n/an/an/an/an/a



The University of Tokyo

Curated by ChEMBL


Assay Description
Binding affinity to Pseudomonas putida KSI by isothermal titration calorimetry


J Med Chem 56: 2155-9 (2013)


Article DOI: 10.1021/jm301603n
BindingDB Entry DOI: 10.7270/Q2PR7X98
More data for this
Ligand-Target Pair