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Compile Data Set for Download or QSAR

Found 78 hits Enz. Inhib. hit(s) with Target = 'Beta-lactamase L1' AND taxid = 40324   
Target
(Institution)
LigandTarget
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
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191983
PNG
(3-((1-((R)-1-amino-1-oxo-3-phenylpropan-2-ylamino)...)
Show SMILES NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc(O)cc(c1)C(O)=O
Show InChI InChI=1S/C21H23N3O6S/c22-18(26)17(8-12-4-2-1-3-5-12)24-20(28)16(6-7-31)23-19(27)13-9-14(21(29)30)11-15(25)10-13/h1-5,9-11,16-17,25,31H,6-8H2,(H2,22,26)(H,23,27)(H,24,28)(H,29,30)/t16?,17-/m1/s1
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2.10n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191983
PNG
(3-((1-((R)-1-amino-1-oxo-3-phenylpropan-2-ylamino)...)
Show SMILES NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc(O)cc(c1)C(O)=O
Show InChI InChI=1S/C21H23N3O6S/c22-18(26)17(8-12-4-2-1-3-5-12)24-20(28)16(6-7-31)23-19(27)13-9-14(21(29)30)11-15(25)10-13/h1-5,9-11,16-17,25,31H,6-8H2,(H2,22,26)(H,23,27)(H,24,28)(H,29,30)/t16?,17-/m1/s1
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5.80n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191987
PNG
(6-((1-((R)-1-carboxy-2-phenylethylamino)-4-mercapt...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C20H21N3O6S/c24-17(13-7-4-8-15(21-13)19(26)27)22-14(9-10-30)18(25)23-16(20(28)29)11-12-5-2-1-3-6-12/h1-8,14,16,30H,9-11H2,(H,22,24)(H,23,25)(H,26,27)(H,28,29)/t14?,16-/m1/s1
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12n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191986
PNG
((2R)-2-(2-(5-fluoro-1H-indole-2-carboxamido)-4-mer...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc2cc(F)ccc2[nH]1
Show InChI InChI=1S/C22H22FN3O4S/c23-15-6-7-16-14(11-15)12-18(24-16)21(28)25-17(8-9-31)20(27)26-19(22(29)30)10-13-4-2-1-3-5-13/h1-7,11-12,17,19,24,31H,8-10H2,(H,25,28)(H,26,27)(H,29,30)/t17?,19-/m1/s1
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12n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191996
PNG
(6-((1-((R)-1-amino-1-oxo-3-phenylpropan-2-ylamino)...)
Show SMILES NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C20H22N4O5S/c21-17(25)16(11-12-5-2-1-3-6-12)24-19(27)14(9-10-30)23-18(26)13-7-4-8-15(22-13)20(28)29/h1-8,14,16,30H,9-11H2,(H2,21,25)(H,23,26)(H,24,27)(H,28,29)/t14?,16-/m1/s1
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26n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092976
PNG
(CHEMBL3586478)
Show SMILES CSCC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O
Show InChI InChI=1/C13H17NO4S3/c1-19-6-4-10(13(18)21-8-12(16)17)14-11(15)7-9-3-2-5-20-9/h2-3,5,10H,4,6-8H2,1H3,(H,14,15)(H,16,17)/t10-/s2
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110n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191987
PNG
(6-((1-((R)-1-carboxy-2-phenylethylamino)-4-mercapt...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C20H21N3O6S/c24-17(13-7-4-8-15(21-13)19(26)27)22-14(9-10-30)18(25)23-16(20(28)29)11-12-5-2-1-3-6-12/h1-8,14,16,30H,9-11H2,(H,22,24)(H,23,25)(H,26,27)(H,28,29)/t14?,16-/m1/s1
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120n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191983
PNG
(3-((1-((R)-1-amino-1-oxo-3-phenylpropan-2-ylamino)...)
Show SMILES NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc(O)cc(c1)C(O)=O
Show InChI InChI=1S/C21H23N3O6S/c22-18(26)17(8-12-4-2-1-3-5-12)24-20(28)16(6-7-31)23-19(27)13-9-14(21(29)30)11-15(25)10-13/h1-5,9-11,16-17,25,31H,6-8H2,(H2,22,26)(H,23,27)(H,24,28)(H,29,30)/t16?,17-/m1/s1
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130n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50192000
PNG
(3-((1-((R)-1-carboxy-2-phenylethylamino)-4-mercapt...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc(O)cc(c1)C(O)=O
Show InChI InChI=1S/C21H22N2O7S/c24-15-10-13(9-14(11-15)20(27)28)18(25)22-16(6-7-31)19(26)23-17(21(29)30)8-12-4-2-1-3-5-12/h1-5,9-11,16-17,24,31H,6-8H2,(H,22,25)(H,23,26)(H,27,28)(H,29,30)/t16?,17-/m1/s1
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140n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191991
PNG
((2R)-2-(4-mercapto-2-(7-nitro-1H-indole-2-carboxam...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc2cccc([N+]([O-])=O)c2[nH]1
Show InChI InChI=1S/C22H22N4O6S/c27-20(25-17(22(29)30)11-13-5-2-1-3-6-13)15(9-10-33)24-21(28)16-12-14-7-4-8-18(26(31)32)19(14)23-16/h1-8,12,15,17,23,33H,9-11H2,(H,24,28)(H,25,27)(H,29,30)/t15?,17-/m1/s1
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150n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191982
PNG
((2R)-2-(4-mercapto-2-(2-(2-nitrophenyl)furan-5-car...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1ccc(o1)-c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C24H23N3O7S/c28-22(26-18(24(30)31)14-15-6-2-1-3-7-15)17(12-13-35)25-23(29)21-11-10-20(34-21)16-8-4-5-9-19(16)27(32)33/h1-11,17-18,35H,12-14H2,(H,25,29)(H,26,28)(H,30,31)/t17?,18-/m1/s1
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160n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092982
PNG
(CHEMBL3585360)
Show SMILES OC(=O)CSC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cccs1
Show InChI InChI=1/C19H18N2O4S2/c22-17(9-13-4-3-7-26-13)21-16(19(25)27-11-18(23)24)8-12-10-20-15-6-2-1-5-14(12)15/h1-7,10,16,20H,8-9,11H2,(H,21,22)(H,23,24)/t16-/s2
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170n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092980
PNG
(CHEMBL3586479)
Show SMILES OC[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O
Show InChI InChI=1/C11H13NO5S2/c13-5-8(11(17)19-6-10(15)16)12-9(14)4-7-2-1-3-18-7/h1-3,8,13H,4-6H2,(H,12,14)(H,15,16)/t8-/s2
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170n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092997
PNG
(CHEMBL3586481)
Show SMILES OC(=O)CSC(=O)[C@H](CCCCNC(=O)Cc1cccs1)NC(=O)Cc1cccs1
Show InChI InChI=1/C20H24N2O5S3/c23-17(11-14-5-3-9-28-14)21-8-2-1-7-16(20(27)30-13-19(25)26)22-18(24)12-15-6-4-10-29-15/h3-6,9-10,16H,1-2,7-8,11-13H2,(H,21,23)(H,22,24)(H,25,26)/t16-/s2
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190n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50192002
PNG
((2R)-2-(2-(4-(benzyloxy)-3,5-dimethylbenzamido)-4-...)
Show SMILES Cc1cc(cc(C)c1OCc1ccccc1)C(=O)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C29H32N2O5S/c1-19-15-23(16-20(2)26(19)36-18-22-11-7-4-8-12-22)27(32)30-24(13-14-37)28(33)31-25(29(34)35)17-21-9-5-3-6-10-21/h3-12,15-16,24-25,37H,13-14,17-18H2,1-2H3,(H,30,32)(H,31,33)(H,34,35)/t24?,25-/m1/s1
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200n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191992
PNG
((2R)-2-(2-(5-chloro-1H-indole-2-carboxamido)-4-mer...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C22H22ClN3O4S/c23-15-6-7-16-14(11-15)12-18(24-16)21(28)25-17(8-9-31)20(27)26-19(22(29)30)10-13-4-2-1-3-5-13/h1-7,11-12,17,19,24,31H,8-10H2,(H,25,28)(H,26,27)(H,29,30)/t17?,19-/m1/s1
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200n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092979
PNG
(CHEMBL3586477)
Show SMILES CC(C)C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O
Show InChI InChI=1/C14H19NO4S2/c1-9(2)6-11(14(19)21-8-13(17)18)15-12(16)7-10-4-3-5-20-10/h3-5,9,11H,6-8H2,1-2H3,(H,15,16)(H,17,18)/t11-/s2
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210n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191998
PNG
((2R)-2-(2-(3-butylpicolinamido)-4-mercaptobutanami...)
Show SMILES CCCCc1ccc(nc1)C(=O)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C23H29N3O4S/c1-2-3-7-17-10-11-18(24-15-17)21(27)25-19(12-13-31)22(28)26-20(23(29)30)14-16-8-5-4-6-9-16/h4-6,8-11,15,19-20,31H,2-3,7,12-14H2,1H3,(H,25,27)(H,26,28)(H,29,30)/t19?,20-/m1/s1
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230n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50192003
PNG
((2R)-2-(2-(3-chloro-2-hydroxynicotinamido)-4-merca...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1c[nH]c(=O)c(Cl)c1
Show InChI InChI=1S/C19H20ClN3O5S/c20-13-9-12(10-21-17(13)25)16(24)22-14(6-7-29)18(26)23-15(19(27)28)8-11-4-2-1-3-5-11/h1-5,9-10,14-15,29H,6-8H2,(H,21,25)(H,22,24)(H,23,26)(H,27,28)/t14?,15-/m1/s1
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260n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092977
PNG
(CHEMBL3586474)
Show SMILES OC(=O)CSC(=O)CNC(=O)Cc1cccs1
Show InChI InChI=1S/C10H11NO4S2/c12-8(4-7-2-1-3-16-7)11-5-10(15)17-6-9(13)14/h1-3H,4-6H2,(H,11,12)(H,13,14)
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280n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092842
PNG
(CHEMBL3586476)
Show SMILES CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O
Show InChI InChI=1S/C16H18N2O2.C4H4O4/c19-16(12-3-4-12)13-5-7-15(8-6-13)20-9-1-2-14-10-17-11-18-14;5-3(6)1-2-4(7)8/h5-8,10-12H,1-4,9H2,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1-
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280n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191989
PNG
((2R)-2-(4-mercapto-2-(2-(naphthalen-1-yloxy)acetam...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)COc1cccc2ccccc12
Show InChI InChI=1S/C25H26N2O5S/c28-23(16-32-22-12-6-10-18-9-4-5-11-19(18)22)26-20(13-14-33)24(29)27-21(25(30)31)15-17-7-2-1-3-8-17/h1-12,20-21,33H,13-16H2,(H,26,28)(H,27,29)(H,30,31)/t20?,21-/m1/s1
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290n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191997
PNG
((2R)-2-(2-(1H-indole-2-carboxamido)-4-mercaptobuta...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc2ccccc2[nH]1
Show InChI InChI=1S/C22H23N3O4S/c26-20(25-19(22(28)29)12-14-6-2-1-3-7-14)17(10-11-30)24-21(27)18-13-15-8-4-5-9-16(15)23-18/h1-9,13,17,19,23,30H,10-12H2,(H,24,27)(H,25,26)(H,28,29)/t17?,19-/m1/s1
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290n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191984
PNG
((2R)-2-(2-(2-(4-bromophenyl)acetamido)-4-mercaptob...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)Cc1ccc(Br)cc1
Show InChI InChI=1S/C21H23BrN2O4S/c22-16-8-6-15(7-9-16)13-19(25)23-17(10-11-29)20(26)24-18(21(27)28)12-14-4-2-1-3-5-14/h1-9,17-18,29H,10-13H2,(H,23,25)(H,24,26)(H,27,28)/t17?,18-/m1/s1
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350n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50192001
PNG
((2R)-2-(2-(2-(4-acetamido-3-nitrophenyl)acetamido)...)
Show SMILES CC(=O)Nc1ccc(CC(=O)NC(CCS)C(=O)N[C@H](Cc2ccccc2)C(O)=O)cc1[N+]([O-])=O
Show InChI InChI=1S/C23H26N4O7S/c1-14(28)24-17-8-7-16(12-20(17)27(33)34)13-21(29)25-18(9-10-35)22(30)26-19(23(31)32)11-15-5-3-2-4-6-15/h2-8,12,18-19,35H,9-11,13H2,1H3,(H,24,28)(H,25,29)(H,26,30)(H,31,32)/t18?,19-/m1/s1
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390n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322612
PNG
(CHEMBL1173797 | alpha-Sulfanyl(2,4-dichlorobenzyl)...)
Show SMILES OP(O)(O)C(=S)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C7H7Cl2O3PS/c8-4-1-2-5(6(9)3-4)7(14)13(10,11)12/h1-3,10-13H
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400n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322612
PNG
(CHEMBL1173797 | alpha-Sulfanyl(2,4-dichlorobenzyl)...)
Show SMILES OP(O)(O)C(=S)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C7H7Cl2O3PS/c8-4-1-2-5(6(9)3-4)7(14)13(10,11)12/h1-3,10-13H
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400n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092978
PNG
(CHEMBL3586475)
Show SMILES C[C@H](NC(=O)Cc1cccs1)C(=O)SCC(O)=O
Show InChI InChI=1/C11H13NO4S2/c1-7(11(16)18-6-10(14)15)12-9(13)5-8-3-2-4-17-8/h2-4,7H,5-6H2,1H3,(H,12,13)(H,14,15)/t7-/s2
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410n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191985
PNG
((2R)-2-(4-mercapto-2-(3-(trimethylsilyl)propanamid...)
Show SMILES C[Si](C)(C)CCC(=O)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C19H30N2O4SSi/c1-27(2,3)12-10-17(22)20-15(9-11-26)18(23)21-16(19(24)25)13-14-7-5-4-6-8-14/h4-8,15-16,26H,9-13H2,1-3H3,(H,20,22)(H,21,23)(H,24,25)/t15?,16-/m1/s1
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520n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191988
PNG
((2R)-2-(2-(4-hydroxy-3,5-dimethylbenzamido)-4-merc...)
Show SMILES Cc1cc(cc(C)c1O)C(=O)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H26N2O5S/c1-13-10-16(11-14(2)19(13)25)20(26)23-17(8-9-30)21(27)24-18(22(28)29)12-15-6-4-3-5-7-15/h3-7,10-11,17-18,25,30H,8-9,12H2,1-2H3,(H,23,26)(H,24,27)(H,28,29)/t17?,18-/m1/s1
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540n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191994
PNG
((2R)-2-(2-(5-hydroxy-1H-indole-2-carboxamido)-4-me...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)c1cc2cc(O)ccc2[nH]1
Show InChI InChI=1S/C22H23N3O5S/c26-15-6-7-16-14(11-15)12-18(23-16)21(28)24-17(8-9-31)20(27)25-19(22(29)30)10-13-4-2-1-3-5-13/h1-7,11-12,17,19,23,26,31H,8-10H2,(H,24,28)(H,25,27)(H,29,30)/t17?,19-/m1/s1
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570n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322601
PNG
(CHEMBL1173800 | alpha-Sulfanyl(4-chlorobenzyl)phos...)
Show SMILES OP(O)(O)C(=S)c1ccc(Cl)cc1
Show InChI InChI=1S/C7H8ClO3PS/c8-6-3-1-5(2-4-6)7(13)12(9,10)11/h1-4,9-12H
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700n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191993
PNG
((2R)-2-(2-(3-cyclohexylpropanamido)-4-mercaptobuta...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)CCC1CCCCC1
Show InChI InChI=1S/C22H32N2O4S/c25-20(12-11-16-7-3-1-4-8-16)23-18(13-14-29)21(26)24-19(22(27)28)15-17-9-5-2-6-10-17/h2,5-6,9-10,16,18-19,29H,1,3-4,7-8,11-15H2,(H,23,25)(H,24,26)(H,27,28)/t18?,19-/m1/s1
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780n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191995
PNG
((2R)-2-(2-(2-(2-chloro-5-nitrophenyl)acetamido)-4-...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)Cc1cc(ccc1Cl)[N+]([O-])=O
Show InChI InChI=1S/C21H22ClN3O6S/c22-16-7-6-15(25(30)31)11-14(16)12-19(26)23-17(8-9-32)20(27)24-18(21(28)29)10-13-4-2-1-3-5-13/h1-7,11,17-18,32H,8-10,12H2,(H,23,26)(H,24,27)(H,28,29)/t17?,18-/m1/s1
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780n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50093027
PNG
(CHEMBL3586482)
Show SMILES OC(=O)CSC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1
Show InChI InChI=1S/C35H46N4O9/c1-5-21(4)30(36-27(40)13-14-28(41)42)32(44)37-29(20(2)3)33(45)39-18-24(17-26(39)31(43)38-35(15-16-35)34(46)47)48-19-23-11-8-10-22-9-6-7-12-25(22)23/h6-12,20-21,24,26,29-30H,5,13-19H2,1-4H3,(H,36,40)(H,37,44)(H,38,43)(H,41,42)(H,46,47)/t21?,24-,26+,29+,30+/m1/s1
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870n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50192004
PNG
((2R)-2-(2-(3-butylpicolinamido)-3-mercaptopropanam...)
Show SMILES CCCCc1ccc(nc1)C(=O)NC(CS)C(=O)N[C@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C22H27N3O4S/c1-2-3-7-16-10-11-17(23-13-16)20(26)25-19(14-30)21(27)24-18(22(28)29)12-15-8-5-4-6-9-15/h4-6,8-11,13,18-19,30H,2-3,7,12,14H2,1H3,(H,24,27)(H,25,26)(H,28,29)/t18-,19?/m1/s1
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880n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50092981
PNG
(CHEMBL3586480)
Show SMILES OC(=O)CSC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1cccs1
Show InChI InChI=1/C17H17NO4S2/c19-15(10-13-7-4-8-23-13)18-14(17(22)24-11-16(20)21)9-12-5-2-1-3-6-12/h1-8,14H,9-11H2,(H,18,19)(H,20,21)/t14-/s2
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950n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Mixed-type inhibition of Stenotrophomonas maltophilia L1 overexpressed in Escherichia coli BL21 (DE3) using imipenem as substrate incubated for 30 mi...


ACS Med Chem Lett 6: 660-4 (2015)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191990
PNG
((2R)-2-(4-mercapto-2-(2-(3-nitrophenyl)acetamido)b...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CCS)NC(=O)Cc1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C21H23N3O6S/c25-19(13-15-7-4-8-16(11-15)24(29)30)22-17(9-10-31)20(26)23-18(21(27)28)12-14-5-2-1-3-6-14/h1-8,11,17-18,31H,9-10,12-13H2,(H,22,25)(H,23,26)(H,27,28)/t17?,18-/m1/s1
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1.03E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322600
PNG
(CHEMBL1173799 | alpha-Sulfanyl(4-bromobenzyl)phosp...)
Show SMILES OP(O)(O)C(=S)c1ccc(Br)cc1
Show InChI InChI=1S/C7H8BrO3PS/c8-6-3-1-5(2-4-6)7(13)12(9,10)11/h1-4,9-12H
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1.70E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322606
PNG
(2-(Sulfanylmethyl)phenylphosphonic acid | CHEMBL11...)
Show SMILES OP(O)(=O)c1ccccc1CS
Show InChI InChI=1S/C7H9O3PS/c8-11(9,10)7-4-2-1-3-6(7)5-12/h1-4,12H,5H2,(H2,8,9,10)
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2.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322605
PNG
(CHEMBL1173337 | Diisopropyl 2-(sulfanylmethyl)phen...)
Show SMILES CC(C)OP(=O)(OC(C)C)c1ccccc1CS
Show InChI InChI=1S/C13H21O3PS/c1-10(2)15-17(14,16-11(3)4)13-8-6-5-7-12(13)9-18/h5-8,10-11,18H,9H2,1-4H3
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3.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50191999
PNG
((2R)-2-(2-(2-(4-bromophenyl)acetamido)-3-mercaptop...)
Show SMILES OC(=O)[C@@H](Cc1ccccc1)NC(=O)C(CS)NC(=O)Cc1ccc(Br)cc1
Show InChI InChI=1S/C20H21BrN2O4S/c21-15-8-6-14(7-9-15)11-18(24)22-17(12-28)19(25)23-16(20(26)27)10-13-4-2-1-3-5-13/h1-9,16-17,28H,10-12H2,(H,22,24)(H,23,25)(H,26,27)/t16-,17?/m1/s1
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3.67E+3n/an/an/an/an/an/an/an/a



University of Virginia

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia L1 metallo beta lactamase


Bioorg Med Chem Lett 16: 5169-75 (2006)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322601
PNG
(CHEMBL1173800 | alpha-Sulfanyl(4-chlorobenzyl)phos...)
Show SMILES OP(O)(O)C(=S)c1ccc(Cl)cc1
Show InChI InChI=1S/C7H8ClO3PS/c8-6-3-1-5(2-4-6)7(13)12(9,10)11/h1-4,9-12H
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3.80E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322613
PNG
(CHEMBL1173798 | alpha-Sulfanyl(2-methoxybenzyl)pho...)
Show SMILES COc1ccccc1C(=S)P(O)(O)O
Show InChI InChI=1S/C8H11O4PS/c1-12-7-5-3-2-4-6(7)8(14)13(9,10)11/h2-5,9-11,13H,1H3
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4.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322611
PNG
(5-Fluoro-2-sulfanyl-phenylphosphonic acid | CHEMBL...)
Show SMILES OP(O)(=O)c1cc(F)ccc1S
Show InChI InChI=1S/C6H6FO3PS/c7-4-1-2-6(12)5(3-4)11(8,9)10/h1-3,12H,(H2,8,9,10)
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4.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322600
PNG
(CHEMBL1173799 | alpha-Sulfanyl(4-bromobenzyl)phosp...)
Show SMILES OP(O)(O)C(=S)c1ccc(Br)cc1
Show InChI InChI=1S/C7H8BrO3PS/c8-6-3-1-5(2-4-6)7(13)12(9,10)11/h1-4,9-12H
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8.40E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322604
PNG
(2-mercaptophenylphosphonic acid | CHEMBL1173336)
Show SMILES OP(O)(=O)c1ccccc1S
Show InChI InChI=1S/C6H7O3PS/c7-10(8,9)5-3-1-2-4-6(5)11/h1-4,11H,(H2,7,8,9)
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9.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322613
PNG
(CHEMBL1173798 | alpha-Sulfanyl(2-methoxybenzyl)pho...)
Show SMILES COc1ccccc1C(=S)P(O)(O)O
Show InChI InChI=1S/C8H11O4PS/c1-12-7-5-3-2-4-6(7)8(14)13(9,10)11/h2-5,9-11,13H,1H3
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9.00E+3n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322604
PNG
(2-mercaptophenylphosphonic acid | CHEMBL1173336)
Show SMILES OP(O)(=O)c1ccccc1S
Show InChI InChI=1S/C6H7O3PS/c7-10(8,9)5-3-1-2-4-6(5)11/h1-4,11H,(H2,7,8,9)
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1.20E+4n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322605
PNG
(CHEMBL1173337 | Diisopropyl 2-(sulfanylmethyl)phen...)
Show SMILES CC(C)OP(=O)(OC(C)C)c1ccccc1CS
Show InChI InChI=1S/C13H21O3PS/c1-10(2)15-17(14,16-11(3)4)13-8-6-5-7-12(13)9-18/h5-8,10-11,18H,9H2,1-4H3
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1.40E+4n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)

More data for this
Ligand-Target Pair
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