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Compile Data Set for Download or QSAR

Found 29 hits of ph data with Target = 'Sortase A (SrtA)'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33298
PNG
(rhodanine, 1)
Show SMILES Cc1ccc(N2C(=S)S\C(=C/c3cc(cc(Br)c3O)[N+]([O-])=O)C2=O)c(C)c1
Show InChI InChI=1S/C18H13BrN2O4S2/c1-9-3-4-14(10(2)5-9)20-17(23)15(27-18(20)26)7-11-6-12(21(24)25)8-13(19)16(11)22/h3-8,22H,1-2H3/b15-7-
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n/an/a 3.70E+3n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33319
PNG
(pyridazinone, 2-6)
Show SMILES Oc1cnn(-c2ccccc2)c(=O)c1OCc1ccccc1
Show InChI InChI=1S/C17H14N2O3/c20-15-11-18-19(14-9-5-2-6-10-14)17(21)16(15)22-12-13-7-3-1-4-8-13/h1-11,20H,12H2
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n/an/a>5.00E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33301
PNG
(rhodanine, 1-2)
Show SMILES Cc1cccc(c1)N1C(=S)S\C(=C/c2cc(cc(Br)c2O)[N+]([O-])=O)C1=O
Show InChI InChI=1S/C17H11BrN2O4S2/c1-9-3-2-4-11(5-9)19-16(22)14(26-17(19)25)7-10-6-12(20(23)24)8-13(18)15(10)21/h2-8,21H,1H3/b14-7-
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n/an/a 1.50E+4n/an/an/an/a7.525



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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33302
PNG
(rhodanine, 1-3)
Show SMILES Oc1c(Br)cc(cc1\C=C1/SC(=S)N(C1=O)c1ccc(cc1)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C16H8BrN3O6S2/c17-12-7-11(20(25)26)5-8(14(12)21)6-13-15(22)18(16(27)28-13)9-1-3-10(4-2-9)19(23)24/h1-7,21H/b13-6-
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n/an/a 1.20E+4n/an/an/an/a7.525



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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33303
PNG
(rhodanine, 1-4)
Show SMILES Cc1ccc(N2C(=S)S\C(=C/c3cc(Br)c(O)c(c3)[N+]([O-])=O)C2=O)c(C)c1
Show InChI InChI=1S/C18H13BrN2O4S2/c1-9-3-4-13(10(2)5-9)20-17(23)15(27-18(20)26)8-11-6-12(19)16(22)14(7-11)21(24)25/h3-8,22H,1-2H3/b15-8-
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n/an/a 3.50E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33304
PNG
(rhodanine, 1-5)
Show SMILES Cc1ccc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc1[N+]([O-])=O
Show InChI InChI=1S/C17H11ClN2O3S2/c1-10-5-6-11(7-14(10)20(22)23)8-15-16(21)19(17(24)25-15)13-4-2-3-12(18)9-13/h2-9H,1H3/b15-8-
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n/an/a>1.00E+6n/an/an/an/a7.525



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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33305
PNG
(rhodanine, 1-6)
Show SMILES Cc1ccc(N2C(=S)S\C(=C/c3cccc(c3)[N+]([O-])=O)C2=O)c(C)c1
Show InChI InChI=1S/C18H14N2O3S2/c1-11-6-7-15(12(2)8-11)19-17(21)16(25-18(19)24)10-13-4-3-5-14(9-13)20(22)23/h3-10H,1-2H3/b16-10-
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n/an/a 1.19E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33306
PNG
(rhodanine, 1-7)
Show SMILES CN1C(=S)S\C(=C/c2cc(cc(Br)c2O)[N+]([O-])=O)C1=O
Show InChI InChI=1S/C11H7BrN2O4S2/c1-13-10(16)8(20-11(13)19)3-5-2-6(14(17)18)4-7(12)9(5)15/h2-4,15H,1H3/b8-3-
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n/an/a 1.40E+4n/an/an/an/a7.525



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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33307
PNG
(rhodanine, 1-8)
Show SMILES CN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2)C1=O
Show InChI InChI=1S/C15H11NO2S2/c1-16-14(17)13(20-15(16)19)9-11-7-8-12(18-11)10-5-3-2-4-6-10/h2-9H,1H3/b13-9-
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n/an/a 4.05E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33308
PNG
(rhodanine, 1-9)
Show SMILES CCCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2)C1=O
Show InChI InChI=1S/C17H15NO2S2/c1-2-10-18-16(19)15(22-17(18)21)11-13-8-9-14(20-13)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3/b15-11-
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n/an/a 1.86E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33309
PNG
(rhodanine, 1-10)
Show SMILES O=C1N(Cc2ccccc2)C(=S)S\C1=C/c1ccc(o1)-c1ccccc1
Show InChI InChI=1S/C21H15NO2S2/c23-20-19(26-21(25)22(20)14-15-7-3-1-4-8-15)13-17-11-12-18(24-17)16-9-5-2-6-10-16/h1-13H,14H2/b19-13-
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n/an/a 4.92E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33310
PNG
(rhodanine, 1-11)
Show SMILES CCN1C(=S)S\C(=C/c2ccc(o2)-c2cccc(Cl)c2)C1=O
Show InChI InChI=1S/C16H12ClNO2S2/c1-2-18-15(19)14(22-16(18)21)9-12-6-7-13(20-12)10-4-3-5-11(17)8-10/h3-9H,2H2,1H3/b14-9-
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n/an/a 1.09E+5n/an/an/an/a7.525



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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33311
PNG
(rhodanine, 1-12)
Show SMILES CCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2[N+]([O-])=O)C1=O
Show InChI InChI=1S/C16H12N2O4S2/c1-2-17-15(19)14(24-16(17)23)9-10-7-8-13(22-10)11-5-3-4-6-12(11)18(20)21/h3-9H,2H2,1H3/b14-9-
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n/an/a 1.04E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33312
PNG
(rhodanine, 1-13)
Show SMILES C=CCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2)C1=O
Show InChI InChI=1S/C17H13NO2S2/c1-2-10-18-16(19)15(22-17(18)21)11-13-8-9-14(20-13)12-6-4-3-5-7-12/h2-9,11H,1,10H2/b15-11-
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n/an/a 1.99E+5n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33313
PNG
(pyridazinone, 2)
Show SMILES COc1c(S)cnn(-c2cccc(Cl)c2)c1=O
Show InChI InChI=1S/C11H9ClN2O2S/c1-16-10-9(17)6-13-14(11(10)15)8-4-2-3-7(12)5-8/h2-6,17H,1H3
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n/an/a 4.50E+3n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33314
PNG
(pyridazinone, 2-1 | pyridazinone, 2-10)
Show SMILES CCOc1c(S)cnn(-c2ccccc2)c1=O
Show InChI InChI=1S/C12H12N2O2S/c1-2-16-11-10(17)8-13-14(12(11)15)9-6-4-3-5-7-9/h3-8,17H,2H2,1H3
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n/an/a 200n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33315
PNG
(pyridazinone, 2-2)
Show SMILES CSc1cnn(-c2ccccc2)c(=O)c1O
Show InChI InChI=1S/C11H10N2O2S/c1-16-9-7-12-13(11(15)10(9)14)8-5-3-2-4-6-8/h2-7,14H,1H3
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University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33316
PNG
(pyridazinone, 2-3)
Show SMILES CCn1ncc(SC)c(O)c1=O
Show InChI InChI=1S/C7H10N2O2S/c1-3-9-7(11)6(10)5(12-2)4-8-9/h4,10H,3H2,1-2H3
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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33317
PNG
(pyridazinone, 2-4)
Show SMILES CSc1cnn(-c2ccccc2)c(=O)c1Cl
Show InChI InChI=1S/C11H9ClN2OS/c1-16-9-7-13-14(11(15)10(9)12)8-5-3-2-4-6-8/h2-7H,1H3
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Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33318
PNG
(pyridazinone, 2-5)
Show SMILES COc1cnn(-c2ccccc2)c(=O)c1S
Show InChI InChI=1S/C11H10N2O2S/c1-15-9-7-12-13(11(14)10(9)16)8-5-3-2-4-6-8/h2-7,16H,1H3
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n/an/a 9.30E+3n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33319
PNG
(pyridazinone, 2-6)
Show SMILES Oc1cnn(-c2ccccc2)c(=O)c1OCc1ccccc1
Show InChI InChI=1S/C17H14N2O3/c20-15-11-18-19(14-9-5-2-6-10-14)17(21)16(15)22-12-13-7-3-1-4-8-13/h1-11,20H,12H2
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University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33302
PNG
(rhodanine, 1-3)
Show SMILES Oc1c(Br)cc(cc1\C=C1/SC(=S)N(C1=O)c1ccc(cc1)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C16H8BrN3O6S2/c17-12-7-11(20(25)26)5-8(14(12)21)6-13-15(22)18(16(27)28-13)9-1-3-10(4-2-9)19(23)24/h1-7,21H/b13-6-
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n/an/a 2.00E+4n/an/an/an/a7.525



University of California at Los Angeles



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A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33306
PNG
(rhodanine, 1-7)
Show SMILES CN1C(=S)S\C(=C/c2cc(cc(Br)c2O)[N+]([O-])=O)C1=O
Show InChI InChI=1S/C11H7BrN2O4S2/c1-13-10(16)8(20-11(13)19)3-5-2-6(14(17)18)4-7(12)9(5)15/h2-4,15H,1H3/b8-3-
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UniChem

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PubMed
n/an/a 1.30E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33308
PNG
(rhodanine, 1-9)
Show SMILES CCCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2)C1=O
Show InChI InChI=1S/C17H15NO2S2/c1-2-10-18-16(19)15(22-17(18)21)11-13-8-9-14(20-13)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3/b15-11-
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UniChem

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n/an/a 5.30E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33311
PNG
(rhodanine, 1-12)
Show SMILES CCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2[N+]([O-])=O)C1=O
Show InChI InChI=1S/C16H12N2O4S2/c1-2-17-15(19)14(24-16(17)23)9-10-7-8-13(22-10)11-5-3-4-6-12(11)18(20)21/h3-9H,2H2,1H3/b14-9-
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n/an/a 7.40E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33312
PNG
(rhodanine, 1-13)
Show SMILES C=CCN1C(=S)S\C(=C/c2ccc(o2)-c2ccccc2)C1=O
Show InChI InChI=1S/C17H13NO2S2/c1-2-10-18-16(19)15(22-17(18)21)11-13-8-9-14(20-13)12-6-4-3-5-7-12/h2-9,11H,1,10H2/b15-11-
PDB
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n/an/a 2.70E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33314
PNG
(pyridazinone, 2-1 | pyridazinone, 2-10)
Show SMILES CCOc1c(S)cnn(-c2ccccc2)c1=O
Show InChI InChI=1S/C12H12N2O2S/c1-2-16-11-10(17)8-13-14(12(11)15)9-6-4-3-5-7-9/h3-8,17H,2H2,1H3
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n/an/a 1.40E+3n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Bacillus anthracis)
BDBM33318
PNG
(pyridazinone, 2-5)
Show SMILES COc1cnn(-c2ccccc2)c(=O)c1S
Show InChI InChI=1S/C11H10N2O2S/c1-15-9-7-12-13(11(14)10(9)16)8-5-3-2-4-6-8/h2-7,16H,1H3
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n/an/a 1.80E+3n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair
Sortase A (SrtA)


(Staphylococcus aureus)
BDBM33300
PNG
(rhodanine, 1-1)
Show SMILES Oc1c(Br)cc(cc1\C=C1/SC(=S)N(C1=O)c1cccc(Cl)c1)[N+]([O-])=O
Show InChI InChI=1S/C16H8BrClN2O4S2/c17-12-7-11(20(23)24)4-8(14(12)21)5-13-15(22)19(16(25)26-13)10-3-1-2-9(18)6-10/h1-7,21H/b13-5-
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UniChem

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PubMed
n/an/a 1.70E+4n/an/an/an/a7.525



University of California at Los Angeles



Assay Description
A total of 30,000 chemical compounds (DiverSet Chemically Diverse Library and Combichem Library, ChemBridge Corp.) were screened for SrtA inhibition ...


Bioorg Med Chem 17: 7174-85 (2009)


Article DOI: 10.1016/j.bmc.2009.08.067
BindingDB Entry DOI: 10.7270/Q26W98F0
More data for this
Ligand-Target Pair