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SMILES: C[C@H](NC(C)=O)C(F)(F)C[C@H]1CC[C@@H](CO1)Oc1nc2c(F)cc(OCC(F)F)c(F)c2n1C

InChI Key: InChIKey=UWEPAEJXEWUTAW-UHTWSYAYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 369674   
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))		BDBM369674
PNG
(US10233156, Example I-214)
Show SMILES C[C@H](NC(C)=O)C(F)(F)C[C@H]1CC[C@@H](CO1)Oc1nc2c(F)cc(OCC(F)F)c(F)c2n1C |r|
Show InChI InChI=1S/C21H25F6N3O4/c1-10(28-11(2)31)21(26,27)7-12-4-5-13(8-32-12)34-20-29-18-14(22)6-15(33-9-16(23)24)17(25)19(18)30(20)3/h6,10,12-13,16H,4-5,7-9H2,1-3H3,(H,28,31)/t10-,12+,13-/m0/s1
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MMDB

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n/an/a 12n/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