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SMILES: CC(N(Cc1ccccc1[N+]([O-])=O)C(=O)NS(=O)(=O)c1ccccc1C)C(=O)NO

InChI Key: InChIKey=RRBIAAODSGBKRW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50100791   
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
Collagenase ColA


(Clostridium perfringens)		BDBM50100791
PNG
(CHEMBL72152 | N-hydroxy-2-[({[(2-methylphenyl)sulf...)
Show SMILES CC(N(Cc1ccccc1[N+]([O-])=O)C(=O)NS(=O)(=O)c1ccccc1C)C(=O)NO
Show InChI InChI=1S/C18H20N4O7S/c1-12-7-3-6-10-16(12)30(28,29)20-18(24)21(13(2)17(23)19-25)11-14-8-4-5-9-15(14)22(26)27/h3-10,13,25H,11H2,1-2H3,(H,19,23)(H,20,24)
KEGG

UniProtKB/SwissProt

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PC sid
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Similars
PubMed
 9n/an/an/an/an/an/an/an/a



The University of Western Australia

Curated by ChEMBL


Assay Description
Inhibitory activity against clostridium histolyticum collagenase

J Med Chem 44: 2253-8 (2001)


BindingDB Entry DOI: 10.7270/Q2X066B7
More data for this
Ligand-Target Pair