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SMILES: CN(C)CC[NH+]1CCC[C@@H](CC1)NC(=O)N1CC[C@@H]2[C@H]1C(=O)N2S([O-])(=O)=O

InChI Key: InChIKey=GEBCLLWWBCMXMB-MJBXVCDLSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50348182   
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
Beta-lactamase


(Pseudomonas aeruginosa (PAO1))		BDBM50348182
PNG
(CHEMBL1800871)
Show SMILES CN(C)CC[NH+]1CCC[C@@H](CC1)NC(=O)N1CC[C@@H]2[C@H]1C(=O)N2S([O-])(=O)=O |r|
Show InChI InChI=1S/C16H29N5O5S/c1-18(2)10-11-19-7-3-4-12(5-8-19)17-16(23)20-9-6-13-14(20)15(22)21(13)27(24,25)26/h12-14H,3-11H2,1-2H3,(H,17,23)(H,24,25,26)/t12-,13+,14-/m0/s1
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Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Merck Research Labs

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa CL5701 AmpC by spectrophotometric assay

Bioorg Med Chem Lett 21: 4267-70 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.065
BindingDB Entry DOI: 10.7270/Q2WW7J1C
More data for this
Ligand-Target Pair