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SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(CCC(O)=O)cc1

InChI Key: InChIKey=OXLUIPKETRQAKZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 36680   
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
Thymidylate synthase


(Lactobacillus casei)		BDBM36680
PNG
(Dansyl derivatives 19A, (S) isomer)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)Oc1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C21H21NO5S/c1-22(2)19-7-3-6-18-17(19)5-4-8-20(18)28(25,26)27-16-12-9-15(10-13-16)11-14-21(23)24/h3-10,12-13H,11,14H2,1-2H3,(H,23,24)
PDB
MMDB

KEGG

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Similars
Article
PubMed
n/an/a 7.40E+4n/an/an/an/a7.420



Northwestern University



Assay Description
The enzyme assay were performed spectrophotometrically by following the absorbance at 340nm using a hewlett Packard 8453 UV spectrophotometer equippe...

Chem Biol 6: 319-31 (1999)


Article DOI: 10.1016/S1074-5521(99)80077-5
BindingDB Entry DOI: 10.7270/Q2S180VB
More data for this
Ligand-Target Pair