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SMILES: NS(=O)(=O)Oc1ccc(NC(=O)Nc2ccc(c(c2C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1

InChI Key: InChIKey=TWHGLWYFEVSFID-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50433075   
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
Carbonic anhydrase


(Candida albicans (Yeast))		BDBM50433075
PNG
(CHEMBL2376276)
Show SMILES NS(=O)(=O)Oc1ccc(NC(=O)Nc2ccc(c(c2C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1
Show InChI InChI=1S/C16H10F9N3O4S/c17-14(18,19)9-5-6-10(12(16(23,24)25)11(9)15(20,21)22)28-13(29)27-7-1-3-8(4-2-7)32-33(26,30)31/h1-6H,(H2,26,30,31)(H2,27,28,29)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
 76n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of recombinant full length Candida albicans NCE103 expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 hydrase...

Bioorg Med Chem Lett 23: 2647-52 (2013)


Article DOI: 10.1016/j.bmcl.2013.02.092
BindingDB Entry DOI: 10.7270/Q28S4R9P
More data for this
Ligand-Target Pair