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BDBM50356895 CHEMBL1915545

SMILES: OC(=O)Cn1nnc(n1)-c1cn(CCc2cc(Br)c(Br)c(Br)c2)nn1

InChI Key: InChIKey=BSPAMFCMXHBGMQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50356895   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Stearoyl-CoA desaturase 1 (SCD1)


(Rattus norvegicus (Rat))
BDBM50356895
PNG
(CHEMBL1915545)
Show SMILES OC(=O)Cn1nnc(n1)-c1cn(CCc2cc(Br)c(Br)c(Br)c2)nn1
Show InChI InChI=1S/C13H10Br3N7O2/c14-8-3-7(4-9(15)12(8)16)1-2-22-5-10(17-20-22)13-18-21-23(19-13)6-11(24)25/h3-5H,1-2,6H2,(H,24,25)
PDB

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Similars

Article
PubMed
n/an/a 1.99E+4n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of rat SCD by rat microsomal assay


Bioorg Med Chem Lett 21: 6505-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.073
BindingDB Entry DOI: 10.7270/Q2VQ332W
More data for this
Ligand-Target Pair