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SMILES: CC(N(Cc1ccccc1[N+]([O-])=O)C(=O)Nc1cccc2ccccc12)C(=O)NO

InChI Key: InChIKey=SDQDRWVNZJYOMM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50100855   
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)		BDBM50100855
PNG
(CHEMBL72471 | N-Hydroxy-2-[3-naphthalen-1-yl-1-(2-...)
Show SMILES CC(N(Cc1ccccc1[N+]([O-])=O)C(=O)Nc1cccc2ccccc12)C(=O)NO
Show InChI InChI=1S/C21H20N4O5/c1-14(20(26)23-28)24(13-16-8-3-5-12-19(16)25(29)30)21(27)22-18-11-6-9-15-7-2-4-10-17(15)18/h2-12,14,28H,13H2,1H3,(H,22,27)(H,23,26)
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 10n/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