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BDBM50302472 CHEMBL572206::N-(2-chlorobenzyl)-6-(3,3,3-trifluoropropoxy)nicotinamide

SMILES: FC(F)(F)CCOc1ccc(cn1)C(=O)NCc1ccccc1Cl

InChI Key: InChIKey=DKAXESBKSVUNGZ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50302472   
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
EBifunctional epoxide hydrolase 2


(Homo sapiens (Human))
BDBM50302472
PNG
(CHEMBL572206 | N-(2-chlorobenzyl)-6-(3,3,3-trifluo...)
Show SMILES FC(F)(F)CCOc1ccc(cn1)C(=O)NCc1ccccc1Cl
Show InChI InChI=1S/C16H14ClF3N2O2/c17-13-4-2-1-3-11(13)9-22-15(23)12-5-6-14(21-10-12)24-8-7-16(18,19)20/h1-6,10H,7-9H2,(H,22,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 21n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of human soluble EH


Bioorg Med Chem Lett 19: 5864-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.074
BindingDB Entry DOI: 10.7270/Q27944SC
More data for this
Ligand-Target Pair
Epoxide hydrolase 2


(Rattus norvegicus)
BDBM50302472
PNG
(CHEMBL572206 | N-(2-chlorobenzyl)-6-(3,3,3-trifluo...)
Show SMILES FC(F)(F)CCOc1ccc(cn1)C(=O)NCc1ccccc1Cl
Show InChI InChI=1S/C16H14ClF3N2O2/c17-13-4-2-1-3-11(13)9-22-15(23)12-5-6-14(21-10-12)24-8-7-16(18,19)20/h1-6,10H,7-9H2,(H,22,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 22n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of rat sEH


Bioorg Med Chem Lett 19: 5864-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.074
BindingDB Entry DOI: 10.7270/Q27944SC
More data for this
Ligand-Target Pair