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SMILES: CC(N(Cc1ccccc1[N+]([O-])=O)Sc1ccccc1[N+]([O-])=O)C(=O)NO

InChI Key: InChIKey=KXABMRVHZONRQF-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50100797   
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)		BDBM50100797
PNG
(CHEMBL74054 | N-Hydroxy-2-[(2-nitro-benzyl)-(2-nit...)
Show SMILES CC(N(Cc1ccccc1[N+]([O-])=O)Sc1ccccc1[N+]([O-])=O)C(=O)NO
Show InChI InChI=1S/C16H16N4O6S/c1-11(16(21)17-22)18(10-12-6-2-3-7-13(12)19(23)24)27-15-9-5-4-8-14(15)20(25)26/h2-9,11,22H,10H2,1H3,(H,17,21)
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 12n/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