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SMILES: C[C@@H](CC[C@H]1OC[C@@H](C[C@@H]1F)Oc1nc2c(F)cc(OCC(F)F)c(F)c2n1C)NC(C)=O

InChI Key: InChIKey=MGEFHUBOXKPNOT-QMPIGLIWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 369657   
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
Acetyl-CoA carboxylase 2


(Homo sapiens (Human))		BDBM369657
PNG
(US10233156, Example I-196)
Show SMILES C[C@@H](CC[C@H]1OC[C@@H](C[C@@H]1F)Oc1nc2c(F)cc(OCC(F)F)c(F)c2n1C)NC(C)=O |r|
Show InChI InChI=1S/C21H26F5N3O4/c1-10(27-11(2)30)4-5-15-13(22)6-12(8-31-15)33-21-28-19-14(23)7-16(32-9-17(24)25)18(26)20(19)29(21)3/h7,10,12-13,15,17H,4-6,8-9H2,1-3H3,(H,27,30)/t10-,12+,13-,15+/m0/s1
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n/an/a 10n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
Recombinant human ACC1 and recombinant human ACC2, which were prepared by the method mentioned above, were preincubated with assay buffer solution (5...

J Med Chem 50: 641-62 (2007)


BindingDB Entry DOI: 10.7270/Q2C53P4Z
More data for this
Ligand-Target Pair