BindingDB logo
myBDB logout

null

SMILES: ONC(=O)[C@H]1COC(=N1)c1ccc(COc2cccc(c2)N(=O)=O)cc1

InChI Key: InChIKey=PSICPJYPYQRIGO-OAHLLOKOSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 81701   
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
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)		BDBM81701
PNG
(LpxC Inhibitor, L2)
Show SMILES ONC(=O)[C@H]1COC(=N1)c1ccc(COc2cccc(c2)N(=O)=O)cc1 |r,c:7|
Show InChI InChI=1S/C17H15N3O6/c21-16(19-22)15-10-26-17(18-15)12-6-4-11(5-7-12)9-25-14-3-1-2-13(8-14)20(23)24/h1-8,15,22H,9-10H2,(H,19,21)/t15-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 560n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research



Assay Description
The LpxC inhibitors were used as the reference for development of flexible alignment-based pharamcophore, pharamcophore mapping study.

Chem Biol Drug Des 71: 45-56 (2008)


Article DOI: 10.1111/j.1747-0285.2007.00608.x
BindingDB Entry DOI: 10.7270/Q2K64GJF
More data for this
Ligand-Target Pair