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SMILES: CC(C)(C)NCc1cc2cc(sc2s1)S(N)(=O)=O

InChI Key: InChIKey=YZBMVCJXJMVFCT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50012228   
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 2


(Homo sapiens (Human))		BDBM50012228
PNG
(5-(tert-Butylamino-methyl)-thieno[2,3-b]thiophene-...)
Show SMILES CC(C)(C)NCc1cc2cc(sc2s1)S(N)(=O)=O
Show InChI InChI=1S/C11H16N2O2S3/c1-11(2,3)13-6-8-4-7-5-9(18(12,14)15)17-10(7)16-8/h4-5,13H,6H2,1-3H3,(H2,12,14,15)
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PubMed
 37n/an/an/an/an/an/an/an/a



Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against human carbonic anhydrase II

J Med Chem 34: 1805-18 (1991)

Checked by Author
BindingDB Entry DOI: 10.7270/Q25D8SFP
More data for this
Ligand-Target Pair