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SMILES: [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccc(cc1)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

InChI Key: InChIKey=QEVAZQXCDCFEAX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 193779   
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


(Bos taurus)		BDBM193779
PNG
(N-(4-(di(1H-indol-3-yl)methyl)phenyl)-2-nitrobenze...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccc(cc1)C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
Show InChI InChI=1S/C29H22N4O4S/c34-33(35)27-11-5-6-12-28(27)38(36,37)32-20-15-13-19(14-16-20)29(23-17-30-25-9-3-1-7-21(23)25)24-18-31-26-10-4-2-8-22(24)26/h1-18,29-32H
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MMDB

KEGG

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.59E+4n/an/an/an/a7.2n/a



Universiti Teknologi MARA (UiTM)



Assay Description
This was assay performed using buffer containing Tris and HEPES at the pH of 7.2-7.9 and a total concentration of 20 mM. 96-well plates were filled w...

Bioorg Chem 68: 90-104 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.011
BindingDB Entry DOI: 10.7270/Q2CJ8C95
More data for this
Ligand-Target Pair