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Compile Data Set for Download or QSAR

Found 31 hits of ic50 data for polymerid = 50002734,50006542   
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
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079602
PNG
(2,5-Dichloro-N-(4,6-dimethyl-pyrimidin-2-yl)-benze...)
Show SMILES Cc1cc(C)nc(NS(=O)(=O)c2cc(Cl)ccc2Cl)n1
Show InChI InChI=1S/C12H11Cl2N3O2S/c1-7-5-8(2)16-12(15-7)17-20(18,19)11-6-9(13)3-4-10(11)14/h3-6H,1-2H3,(H,15,16,17)
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n/an/a 0.0000330n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079609
PNG
(4-Fluoro-N-(4-methyl-pyrimidin-2-yl)-benzenesulfon...)
Show SMILES Cc1ccnc(NS(=O)(=O)c2ccc(F)cc2)n1
Show InChI InChI=1S/C11H10FN3O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,1H3,(H,13,14,15)
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PubMed
n/an/a 0.0000390n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079603
PNG
(4-Bromo-N-(4-methyl-pyrimidin-2-yl)-benzenesulfona...)
Show SMILES Cc1ccnc(NS(=O)(=O)c2ccc(Br)cc2)n1
Show InChI InChI=1S/C11H10BrN3O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,1H3,(H,13,14,15)
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n/an/a 0.0000590n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079607
PNG
(2,5-Dichloro-N-thiazol-2-yl-benzenesulfonamide | C...)
Show SMILES Clc1ccc(Cl)c(c1)S(=O)(=O)Nc1nccs1
Show InChI InChI=1S/C9H6Cl2N2O2S2/c10-6-1-2-7(11)8(5-6)17(14,15)13-9-12-3-4-16-9/h1-5H,(H,12,13)
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n/an/a 0.0000850n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079606
PNG
(2,5-Dichloro-N-(4-methyl-pyrimidin-2-yl)-benzenesu...)
Show SMILES Cc1ccnc(NS(=O)(=O)c2cc(Cl)ccc2Cl)n1
Show InChI InChI=1S/C11H9Cl2N3O2S/c1-7-4-5-14-11(15-7)16-19(17,18)10-6-8(12)2-3-9(10)13/h2-6H,1H3,(H,14,15,16)
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n/an/a 0.0000970n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079608
PNG
(CHEMBL293152 | N-(4-Chloro-6-methoxy-pyrimidin-2-y...)
Show SMILES COc1cc(Cl)nc(NS(=O)(=O)c2ccc(F)cc2)n1
Show InChI InChI=1S/C11H9ClFN3O3S/c1-19-10-6-9(12)14-11(15-10)16-20(17,18)8-4-2-7(13)3-5-8/h2-6H,1H3,(H,14,15,16)
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n/an/a 0.000111n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079605
PNG
(4-Fluoro-N-(5-methyl-pyridin-2-yl)-benzenesulfonam...)
Show SMILES Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)nc1
Show InChI InChI=1S/C12H11FN2O2S/c1-9-2-7-12(14-8-9)15-18(16,17)11-5-3-10(13)4-6-11/h2-8H,1H3,(H,14,15)
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n/an/a 0.000152n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079601
PNG
(CHEMBL293269 | N-(4-Methyl-pyrimidin-2-yl)-2-nitro...)
Show SMILES Cc1ccnc(NS(=O)(=O)c2ccccc2[N+]([O-])=O)n1
Show InChI InChI=1S/C11H10N4O4S/c1-8-6-7-12-11(13-8)14-20(18,19)10-5-3-2-4-9(10)15(16)17/h2-7H,1H3,(H,12,13,14)
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n/an/a 0.000287n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50079604
PNG
(2,5-Dichloro-N-(5-methyl-thiazol-2-yl)-benzenesulf...)
Show SMILES Cc1cnc(NS(=O)(=O)c2cc(Cl)ccc2Cl)s1
Show InChI InChI=1S/C10H8Cl2N2O2S2/c1-6-5-13-10(17-6)14-18(15,16)9-4-7(11)2-3-8(9)12/h2-5H,1H3,(H,13,14)
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n/an/a>0.000309n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004707
PNG
(CHEMBL2269035)
Show SMILES Cc1cc(C)n2nc(nc2n1)S(=O)(=O)Nc1c(F)ccc2cccnc12
Show InChI InChI=1S/C16H13FN6O2S/c1-9-8-10(2)23-15(19-9)20-16(21-23)26(24,25)22-14-12(17)6-5-11-4-3-7-18-13(11)14/h3-8,22H,1-2H3
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n/an/a 7.70n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004746
PNG
(CHEMBL2269037)
Show SMILES Cc1cc(C)n2nc(nc2n1)S(=O)(=O)Nc1c(Br)ccc2cccnc12
Show InChI InChI=1S/C16H13BrN6O2S/c1-9-8-10(2)23-15(19-9)20-16(21-23)26(24,25)22-14-12(17)6-5-11-4-3-7-18-13(11)14/h3-8,22H,1-2H3
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PubMed
n/an/a 8.70n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004747
PNG
(CHEMBL2269036)
Show SMILES Cc1cc(C)n2nc(nc2n1)S(=O)(=O)Nc1c(Cl)ccc2cccnc12
Show InChI InChI=1S/C16H13ClN6O2S/c1-9-8-10(2)23-15(19-9)20-16(21-23)26(24,25)22-14-12(17)6-5-11-4-3-7-18-13(11)14/h3-8,22H,1-2H3
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PubMed
n/an/a 9.40n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216782
PNG
(CHEMBL291948)
Show SMILES Cc1cccc(c1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H12N2O4/c1-9-3-2-4-10(7-9)12(17)19-8-15-6-5-11(16)14-13(15)18/h2-7H,8H2,1H3,(H,14,16,18)
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n/an/a 16n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004706
PNG
(CHEMBL2269029)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)ccc2cccnc12
Show InChI InChI=1S/C15H11FN6O2S/c1-9-6-8-22-14(18-9)19-15(20-22)25(23,24)21-13-11(16)5-4-10-3-2-7-17-12(10)13/h2-8,21H,1H3
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n/an/a 17n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004709
PNG
(CHEMBL2269031)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(Br)ccc2cccnc12
Show InChI InChI=1S/C15H11BrN6O2S/c1-9-6-8-22-14(18-9)19-15(20-22)25(23,24)21-13-11(16)5-4-10-3-2-7-17-12(10)13/h2-8,21H,1H3
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n/an/a 19n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004719
PNG
(CHEMBL2269024)
Show SMILES Cc1cc(C)n2nc(nc2n1)S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C16H14N6O2S/c1-10-9-11(2)22-15(18-10)19-16(20-22)25(23,24)21-13-7-3-5-12-6-4-8-17-14(12)13/h3-9,21H,1-2H3
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n/an/a 32n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004708
PNG
(FLUMETSULAM)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)cccc1F
Show InChI InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3
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n/an/a 32n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004712
PNG
(CHEMBL2269030)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(Cl)ccc2cccnc12
Show InChI InChI=1S/C15H11ClN6O2S/c1-9-6-8-22-14(18-9)19-15(20-22)25(23,24)21-13-11(16)5-4-10-3-2-7-17-12(10)13/h2-8,21H,1H3
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PubMed
n/an/a 37n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216778
PNG
(CHEMBL57215)
Show SMILES Clc1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C12H9ClN2O4/c13-9-3-1-8(2-4-9)11(17)19-7-15-6-5-10(16)14-12(15)18/h1-6H,7H2,(H,14,16,18)
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n/an/a 51n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216775
PNG
(CHEMBL57654)
Show SMILES Brc1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C12H9BrN2O4/c13-9-3-1-8(2-4-9)11(17)19-7-15-6-5-10(16)14-12(15)18/h1-6H,7H2,(H,14,16,18)
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n/an/a 55n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216780
PNG
(CHEMBL58352)
Show SMILES O=C(OCn1ccc(=O)[nH]c1=O)c1ccccc1
Show InChI InChI=1S/C12H10N2O4/c15-10-6-7-14(12(17)13-10)8-18-11(16)9-4-2-1-3-5-9/h1-7H,8H2,(H,13,15,17)
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n/an/a 55n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216774
PNG
(CHEMBL58964)
Show SMILES Fc1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C12H9FN2O4/c13-9-3-1-8(2-4-9)11(17)19-7-15-6-5-10(16)14-12(15)18/h1-6H,7H2,(H,14,16,18)
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n/an/a 56n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004717
PNG
(CHEMBL2269025)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(ccc2cccnc12)C#N
Show InChI InChI=1S/C16H11N7O2S/c1-10-6-8-23-15(19-10)20-16(21-23)26(24,25)22-14-12(9-17)5-4-11-3-2-7-18-13(11)14/h2-8,22H,1H3
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n/an/a 64n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) GST-tagged acetolactate synthase expressed in Escherichia coli by modified Westerfeld method


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216779
PNG
(CHEMBL58200)
Show SMILES FC(F)(F)c1cc(Cl)c(C(=O)OCn2ccc(=O)[nH]c2=O)c(Cl)c1
Show InChI InChI=1S/C13H7Cl2F3N2O4/c14-7-3-6(13(16,17)18)4-8(15)10(7)11(22)24-5-20-2-1-9(21)19-12(20)23/h1-4H,5H2,(H,19,21,23)
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n/an/a>100n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216776
PNG
(CHEMBL58689)
Show SMILES COc1ccccc1C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H12N2O5/c1-19-10-5-3-2-4-9(10)12(17)20-8-15-7-6-11(16)14-13(15)18/h2-7H,8H2,1H3,(H,14,16,18)
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n/an/a>100n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216783
PNG
(CHEMBL293995)
Show SMILES COc1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H12N2O5/c1-19-10-4-2-9(3-5-10)12(17)20-8-15-7-6-11(16)14-13(15)18/h2-7H,8H2,1H3,(H,14,16,18)
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n/an/a>100n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216773
PNG
(CHEMBL61025)
Show SMILES Ic1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C12H9IN2O4/c13-9-3-1-8(2-4-9)11(17)19-7-15-6-5-10(16)14-12(15)18/h1-6H,7H2,(H,14,16,18)
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n/an/a>100n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50216781
PNG
(CHEMBL58918)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)OCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C12H9N3O6/c16-10-5-6-14(12(18)13-10)7-21-11(17)8-1-3-9(4-2-8)15(19)20/h1-6H,7H2,(H,13,16,18)
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n/an/a>100n/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetolactate synthase (ALS) enzyme by using the rape-root growth method


Citation and Details
More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004708
PNG
(FLUMETSULAM)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)cccc1F
Show InChI InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3
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n/an/a 939n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) S4-Hra GST-tagged acetolactate synthase mutant expressed in Escherichia coli by modified Westerfe...


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004707
PNG
(CHEMBL2269035)
Show SMILES Cc1cc(C)n2nc(nc2n1)S(=O)(=O)Nc1c(F)ccc2cccnc12
Show InChI InChI=1S/C16H13FN6O2S/c1-9-8-10(2)23-15(19-9)20-16(21-23)26(24,25)22-14-12(17)6-5-11-4-3-7-18-13(11)14/h3-8,22H,1-2H3
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PubMed
n/an/a 1.47E+4n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) S4-Hra GST-tagged acetolactate synthase mutant expressed in Escherichia coli by modified Westerfe...


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Nicotiana tabacum)
BDBM50004706
PNG
(CHEMBL2269029)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)ccc2cccnc12
Show InChI InChI=1S/C15H11FN6O2S/c1-9-6-8-22-14(18-9)19-15(20-22)25(23,24)21-13-11(16)5-4-10-3-2-7-17-12(10)13/h2-8,21H,1H3
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PubMed
n/an/a 1.65E+4n/an/an/an/an/an/a



Seoul Women's University

Curated by ChEMBL


Assay Description
Inhibition of wild type Nicotiana tabacum (tobacco) S4-Hra GST-tagged acetolactate synthase mutant expressed in Escherichia coli by modified Westerfe...


Biochem Biophys Res Commun 258: 797-801 (1999)

More data for this
Ligand-Target Pair