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BDBM50218763 CHEMBL67946

SMILES: CC(N1C(=O)C(CS1(=O)=O)NC(=O)Oc1ccc(Cl)cc1)C(=O)OC(C)(C)C

InChI Key: InChIKey=FIZVUZGXYVCAPI-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50218763   
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
Penicillin-binding protein 3


(Staphylococcus aureus)
BDBM50218763
PNG
(CHEMBL67946)
Show SMILES CC(N1C(=O)C(CS1(=O)=O)NC(=O)Oc1ccc(Cl)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C17H21ClN2O7S/c1-10(15(22)27-17(2,3)4)20-14(21)13(9-28(20,24)25)19-16(23)26-12-7-5-11(18)6-8-12/h5-8,10,13H,9H2,1-4H3,(H,19,23)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>5.77E+5n/an/an/an/an/an/a



Procter& Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Penicillin-binding protein 3 (PBP3) from Staphylococcus aureus


Bioorg Med Chem Lett 11: 2111-5 (2001)


BindingDB Entry DOI: 10.7270/Q26H4KKT
More data for this
Ligand-Target Pair
Cell division protein FtsI (Peptidoglycan synthetase)


(Staphylococcus aureus)
BDBM50218763
PNG
(CHEMBL67946)
Show SMILES CC(N1C(=O)C(CS1(=O)=O)NC(=O)Oc1ccc(Cl)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C17H21ClN2O7S/c1-10(15(22)27-17(2,3)4)20-14(21)13(9-28(20,24)25)19-16(23)26-12-7-5-11(18)6-8-12/h5-8,10,13H,9H2,1-4H3,(H,19,23)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>5.77E+5n/an/an/an/an/an/a



Procter& Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Penicillin-binding protein 1 (PBP1) from Staphylococcus aureus


Bioorg Med Chem Lett 11: 2111-5 (2001)


BindingDB Entry DOI: 10.7270/Q26H4KKT
More data for this
Ligand-Target Pair
Penicillin-binding protein


(Staphylococcus aureus)
BDBM50218763
PNG
(CHEMBL67946)
Show SMILES CC(N1C(=O)C(CS1(=O)=O)NC(=O)Oc1ccc(Cl)cc1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C17H21ClN2O7S/c1-10(15(22)27-17(2,3)4)20-14(21)13(9-28(20,24)25)19-16(23)26-12-7-5-11(18)6-8-12/h5-8,10,13H,9H2,1-4H3,(H,19,23)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>5.77E+5n/an/an/an/an/an/a



Procter& Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Penicillin-binding protein 2 (PBP2) from Staphylococcus aureus


Bioorg Med Chem Lett 11: 2111-5 (2001)


BindingDB Entry DOI: 10.7270/Q26H4KKT
More data for this
Ligand-Target Pair