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PubChem AID 1392

Compile data set for download or QSAR
Found 52 hits of Enzyme Inhibition Constant Data   
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
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43341
PNG
((Z,3R)-4-formyl-3-(2-ketoethyl)hex-4-enoic acid 2-...)
Show SMILES C\C=C(/C=O)[C@H](CC=O)CC(=O)OCCc1ccc(O)cc1
Show InChI InChI=1S/C17H20O5/c1-2-14(12-19)15(7-9-18)11-17(21)22-10-8-13-3-5-16(20)6-4-13/h2-6,9,12,15,20H,7-8,10-11H2,1H3/b14-2+/t15-/m1/s1
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n/an/a 1.29E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM41255
PNG
(2,5-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-12-7-10-17(24-2)18(11-12)25(21,22)19-15-8-9-16(20)14-6-4-3-5-13(14)15/h3-11,19-20H,1-2H3
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n/an/a 1.53E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43311
PNG
(3,4-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-17-10-7-12(11-18(17)24-2)25(21,22)19-15-8-9-16(20)14-6-4-3-5-13(14)15/h3-11,19-20H,1-2H3
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n/an/a 1.54E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43306
PNG
(4-fluoranyl-N-(4-oxidanylnaphthalen-1-yl)benzenesu...)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C16H12FNO3S/c17-11-5-7-12(8-6-11)22(20,21)18-15-9-10-16(19)14-4-2-1-3-13(14)15/h1-10,18-19H
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n/an/a 1.73E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43334
PNG
(3,4-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-16-10-8-13(11-17(16)24-2)25(21,22)19-18-14-6-4-3-5-12(14)7-9-15(18)20/h3-11,19-20H,1-2H3
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n/an/a 1.79E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43304
PNG
(4-methoxy-N-(2-oxidanylnaphthalen-1-yl)benzenesulf...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C17H15NO4S/c1-22-13-7-9-14(10-8-13)23(20,21)18-17-15-5-3-2-4-12(15)6-11-16(17)19/h2-11,18-19H,1H3
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n/an/a 1.93E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43294
PNG
(2,5-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-13-8-10-16(24-2)17(11-13)25(21,22)19-18-14-6-4-3-5-12(14)7-9-15(18)20/h3-11,19-20H,1-2H3
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n/an/a 1.94E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43305
PNG
(N-(4-hydroxy-1-naphthalenyl)benzenesulfonamide | N...)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C16H13NO3S/c18-16-11-10-15(13-8-4-5-9-14(13)16)17-21(19,20)12-6-2-1-3-7-12/h1-11,17-18H
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n/an/a 2.01E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43336
PNG
(4-methyl-N-(2-oxidanylnaphthalen-1-yl)benzenesulfo...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C17H15NO3S/c1-12-6-9-14(10-7-12)22(20,21)18-17-15-5-3-2-4-13(15)8-11-16(17)19/h2-11,18-19H,1H3
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n/an/a 2.29E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43307
PNG
(4-methyl-N-(4-oxidanylnaphthalen-1-yl)benzenesulfo...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C17H15NO3S/c1-12-6-8-13(9-7-12)22(20,21)18-16-10-11-17(19)15-5-3-2-4-14(15)16/h2-11,18-19H,1H3
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n/an/a 2.84E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43335
PNG
(N-(2-hydroxy-1-naphthalenyl)benzenesulfonamide | N...)
Show SMILES Oc1ccc2ccccc2c1NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H13NO3S/c18-15-11-10-12-6-4-5-9-14(12)16(15)17-21(19,20)13-7-2-1-3-8-13/h1-11,17-18H
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n/an/a 2.89E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43333
PNG
(4-fluoranyl-N-(2-oxidanylnaphthalen-1-yl)benzenesu...)
Show SMILES Oc1ccc2ccccc2c1NS(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C16H12FNO3S/c17-12-6-8-13(9-7-12)22(20,21)18-16-14-4-2-1-3-11(14)5-10-15(16)19/h1-10,18-19H
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n/an/a 2.95E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43320
PNG
(3,4-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzami...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-23-16-10-8-13(11-17(16)24-2)19(22)20-18-14-6-4-3-5-12(14)7-9-15(18)21/h3-11,21H,1-2H3,(H,20,22)
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n/an/a 3.31E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43339
PNG
(4-amino-1-naphthalenol;hydrochloride | 4-amino-1-n...)
Show SMILES Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C10H9NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H,11H2
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n/an/a 3.75E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43308
PNG
(N-(4-hydroxy-1-naphthalenyl)-1-naphthalenesulfonam...)
Show SMILES Oc1ccc(NS(=O)(=O)c2cccc3ccccc23)c2ccccc12
Show InChI InChI=1S/C20H15NO3S/c22-19-13-12-18(16-9-3-4-10-17(16)19)21-25(23,24)20-11-5-7-14-6-1-2-8-15(14)20/h1-13,21-22H
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n/an/a 4.14E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43328
PNG
(1-(4-hydroxy-1-naphthalenyl)-3-phenylurea | 1-(4-h...)
Show SMILES Oc1ccc(NC(=O)Nc2ccccc2)c2ccccc12
Show InChI InChI=1S/C17H14N2O2/c20-16-11-10-15(13-8-4-5-9-14(13)16)19-17(21)18-12-6-2-1-3-7-12/h1-11,20H,(H2,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43337
PNG
(2,5-dimethoxy-N-(1-naphthalenyl)benzenesulfonamide...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1cccc2ccccc12
Show InChI InChI=1S/C18H17NO4S/c1-22-14-10-11-17(23-2)18(12-14)24(20,21)19-16-9-5-7-13-6-3-4-8-15(13)16/h3-12,19H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43338
PNG
(2,5-dimethoxy-N-(8-oxidanylquinolin-5-yl)benzenesu...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c2ncccc12
Show InChI InChI=1S/C17H16N2O5S/c1-23-11-5-8-15(24-2)16(10-11)25(21,22)19-13-6-7-14(20)17-12(13)4-3-9-18-17/h3-10,19-20H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43331
PNG
(1-(2-hydroxy-1-naphthalenyl)-3-phenylurea | 1-(2-h...)
Show SMILES Oc1ccc2ccccc2c1NC(=O)Nc1ccccc1
Show InChI InChI=1S/C17H14N2O2/c20-15-11-10-12-6-4-5-9-14(12)16(15)19-17(21)18-13-7-2-1-3-8-13/h1-11,20H,(H2,18,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43293
PNG
(N-(4-cyano-1-naphthalenyl)-2,5-dimethoxybenzenesul...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(C#N)c2ccccc12
Show InChI InChI=1S/C19H16N2O4S/c1-24-14-8-10-18(25-2)19(11-14)26(22,23)21-17-9-7-13(12-20)15-5-3-4-6-16(15)17/h3-11,21H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43301
PNG
(4-methoxy-N-(7-oxidanylnaphthalen-1-yl)benzenesulf...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cccc2ccc(O)cc12
Show InChI InChI=1S/C17H15NO4S/c1-22-14-7-9-15(10-8-14)23(20,21)18-17-4-2-3-12-5-6-13(19)11-16(12)17/h2-11,18-19H,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43310
PNG
(N-(4-hydroxy-1-naphthalenyl)-4-(trifluoromethoxy)b...)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c2ccccc12
Show InChI InChI=1S/C17H12F3NO4S/c18-17(19,20)25-11-5-7-12(8-6-11)26(23,24)21-15-9-10-16(22)14-4-2-1-3-13(14)15/h1-10,21-22H
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43330
PNG
(1-(2,5-dimethoxyphenyl)-3-(1H-indol-5-yl)urea | PC...)
Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc3[nH]ccc3c2)c1
Show InChI InChI=1S/C17H17N3O3/c1-22-13-4-6-16(23-2)15(10-13)20-17(21)19-12-3-5-14-11(9-12)7-8-18-14/h3-10,18H,1-2H3,(H2,19,20,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43315
PNG
(N-(1H-indol-5-yl)-4-methoxy-benzamide | N-(1H-indo...)
Show SMILES COc1ccc(cc1)C(=O)Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C16H14N2O2/c1-20-14-5-2-11(3-6-14)16(19)18-13-4-7-15-12(10-13)8-9-17-15/h2-10,17H,1H3,(H,18,19)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43325
PNG
(1-(4-fluorophenyl)-3-(4-hydroxy-1-naphthalenyl)ure...)
Show SMILES Oc1ccc(NC(=O)Nc2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C17H13FN2O2/c18-11-5-7-12(8-6-11)19-17(22)20-15-9-10-16(21)14-4-2-1-3-13(14)15/h1-10,21H,(H2,19,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43296
PNG
(N-(3-hydroxyphenyl)-2,5-dimethoxy-benzenesulfonami...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1cccc(O)c1
Show InChI InChI=1S/C14H15NO5S/c1-19-12-6-7-13(20-2)14(9-12)21(17,18)15-10-4-3-5-11(16)8-10/h3-9,15-16H,1-2H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43302
PNG
((8-aminonaphthalen-2-yl) 4-methoxybenzenesulfonate...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Oc1ccc2cccc(N)c2c1
Show InChI InChI=1S/C17H15NO4S/c1-21-13-7-9-15(10-8-13)23(19,20)22-14-6-5-12-3-2-4-17(18)16(12)11-14/h2-11H,18H2,1H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43312
PNG
(4-(4-methoxyphenyl)-N-(4-oxidanylnaphthalen-1-yl)b...)
Show SMILES COc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C23H19NO4S/c1-28-18-10-6-16(7-11-18)17-8-12-19(13-9-17)29(26,27)24-22-14-15-23(25)21-5-3-2-4-20(21)22/h2-15,24-25H,1H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43317
PNG
(2,5-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzami...)
Show SMILES COc1ccc(OC)c(c1)C(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-23-13-8-10-17(24-2)15(11-13)19(22)20-18-14-6-4-3-5-12(14)7-9-16(18)21/h3-11,21H,1-2H3,(H,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43329
PNG
(1-(2,5-dimethoxyphenyl)-3-(2-hydroxy-1-naphthaleny...)
Show SMILES COc1ccc(OC)c(NC(=O)Nc2c(O)ccc3ccccc23)c1
Show InChI InChI=1S/C19H18N2O4/c1-24-13-8-10-17(25-2)15(11-13)20-19(23)21-18-14-6-4-3-5-12(14)7-9-16(18)22/h3-11,22H,1-2H3,(H2,20,21,23)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43291
PNG
(2,5-dimethoxy-N-(7-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1cccc2ccc(O)cc12
Show InChI InChI=1S/C18H17NO5S/c1-23-14-8-9-17(24-2)18(11-14)25(21,22)19-16-5-3-4-12-6-7-13(20)10-15(12)16/h3-11,19-20H,1-2H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43297
PNG
(N-(4-hydroxyphenyl)-2,5-dimethoxy-benzenesulfonami...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)cc1
Show InChI InChI=1S/C14H15NO5S/c1-19-12-7-8-13(20-2)14(9-12)21(17,18)15-10-3-5-11(16)6-4-10/h3-9,15-16H,1-2H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43313
PNG
(4-methoxy-N-(4-oxidanylnaphthalen-1-yl)benzamide |...)
Show SMILES COc1ccc(cc1)C(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H15NO3/c1-22-13-8-6-12(7-9-13)18(21)19-16-10-11-17(20)15-5-3-2-4-14(15)16/h2-11,20H,1H3,(H,19,21)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43319
PNG
(3,4-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzami...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-23-17-10-7-12(11-18(17)24-2)19(22)20-15-8-9-16(21)14-6-4-3-5-13(14)15/h3-11,21H,1-2H3,(H,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43327
PNG
(1-(2,5-dimethoxyphenyl)-3-(4-hydroxy-1-naphthaleny...)
Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc(O)c3ccccc23)c1
Show InChI InChI=1S/C19H18N2O4/c1-24-12-7-10-18(25-2)16(11-12)21-19(23)20-15-8-9-17(22)14-6-4-3-5-13(14)15/h3-11,22H,1-2H3,(H2,20,21,23)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43299
PNG
(2,5-dimethoxy-N-(4-methoxyphenyl)benzenesulfonamid...)
Show SMILES COc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1
Show InChI InChI=1S/C15H17NO5S/c1-19-12-6-4-11(5-7-12)16-22(17,18)15-10-13(20-2)8-9-14(15)21-3/h4-10,16H,1-3H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43326
PNG
(1-(4-hydroxy-1-naphthalenyl)-3-(4-methylphenyl)ure...)
Show SMILES Cc1ccc(NC(=O)Nc2ccc(O)c3ccccc23)cc1
Show InChI InChI=1S/C18H16N2O2/c1-12-6-8-13(9-7-12)19-18(22)20-16-10-11-17(21)15-5-3-2-4-14(15)16/h2-11,21H,1H3,(H2,19,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43324
PNG
(1-(2-hydroxy-1-naphthalenyl)-3-(4-methoxyphenyl)ur...)
Show SMILES COc1ccc(NC(=O)Nc2c(O)ccc3ccccc23)cc1
Show InChI InChI=1S/C18H16N2O3/c1-23-14-9-7-13(8-10-14)19-18(22)20-17-15-5-3-2-4-12(15)6-11-16(17)21/h2-11,21H,1H3,(H2,19,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43323
PNG
(1-(1H-indol-5-yl)-3-(4-methoxyphenyl)urea | PC-062...)
Show SMILES COc1ccc(NC(=O)Nc2ccc3[nH]ccc3c2)cc1
Show InChI InChI=1S/C16H15N3O2/c1-21-14-5-2-12(3-6-14)18-16(20)19-13-4-7-15-11(10-13)8-9-17-15/h2-10,17H,1H3,(H2,18,19,20)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43322
PNG
(1-(4-hydroxy-1-naphthalenyl)-3-(4-methoxyphenyl)ur...)
Show SMILES COc1ccc(NC(=O)Nc2ccc(O)c3ccccc23)cc1
Show InChI InChI=1S/C18H16N2O3/c1-23-13-8-6-12(7-9-13)19-18(22)20-16-10-11-17(21)15-5-3-2-4-14(15)16/h2-11,21H,1H3,(H2,19,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43318
PNG
(N-(1H-indol-5-yl)-2,5-dimethoxy-benzamide | N-(1H-...)
Show SMILES COc1ccc(OC)c(c1)C(=O)Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C17H16N2O3/c1-21-13-4-6-16(22-2)14(10-13)17(20)19-12-3-5-15-11(9-12)7-8-18-15/h3-10,18H,1-2H3,(H,19,20)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43316
PNG
(2,5-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzami...)
Show SMILES COc1ccc(OC)c(c1)C(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-23-12-7-10-18(24-2)15(11-12)19(22)20-16-8-9-17(21)14-6-4-3-5-13(14)16/h3-11,21H,1-2H3,(H,20,22)
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43309
PNG
(N-(4-hydroxy-1-naphthalenyl)-3-(trifluoromethoxy)b...)
Show SMILES Oc1ccc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2)c2ccccc12
Show InChI InChI=1S/C17H12F3NO4S/c18-17(19,20)25-11-4-3-5-12(10-11)26(23,24)21-15-8-9-16(22)14-7-2-1-6-13(14)15/h1-10,21-22H
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43300
PNG
(4-methoxy-N-phenyl-benzenesulfonamide | 4-methoxy-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccccc1
Show InChI InChI=1S/C13H13NO3S/c1-17-12-7-9-13(10-8-12)18(15,16)14-11-5-3-2-4-6-11/h2-10,14H,1H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43298
PNG
(2,5-dimethoxy-N-(3-methyl-4-oxidanyl-phenyl)benzen...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c(C)c1
Show InChI InChI=1S/C15H17NO5S/c1-10-8-11(4-6-13(10)17)16-22(18,19)15-9-12(20-2)5-7-14(15)21-3/h4-9,16-17H,1-3H3
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43340
PNG
(5-amino-1-naphthalenol;hydrochloride | 5-amino-1-n...)
Show SMILES Nc1cccc2c(O)cccc12
Show InChI InChI=1S/C10H9NO/c11-9-5-1-4-8-7(9)3-2-6-10(8)12/h1-6,12H,11H2
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43332
PNG
(N-(1H-indol-5-yl)-2,5-dimethoxy-benzenesulfonamide...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C16H16N2O4S/c1-21-13-4-6-15(22-2)16(10-13)23(19,20)18-12-3-5-14-11(9-12)7-8-17-14/h3-10,17-18H,1-2H3
PDB
MMDB

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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43321
PNG
(N-(1H-indol-5-yl)-3,4-dimethoxy-benzamide | N-(1H-...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1ccc2[nH]ccc2c1
Show InChI InChI=1S/C17H16N2O3/c1-21-15-6-3-12(10-16(15)22-2)17(20)19-13-4-5-14-11(9-13)7-8-18-14/h3-10,18H,1-2H3,(H,19,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43314
PNG
(4-methoxy-N-(2-oxidanylnaphthalen-1-yl)benzamide |...)
Show SMILES COc1ccc(cc1)C(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C18H15NO3/c1-22-14-9-6-13(7-10-14)18(21)19-17-15-5-3-2-4-12(15)8-11-16(17)20/h2-11,20H,1H3,(H,19,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43303
PNG
((4-aminonaphthalen-1-yl) 2,5-dimethoxybenzenesulfo...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Oc1ccc(N)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-22-12-7-9-17(23-2)18(11-12)25(20,21)24-16-10-8-15(19)13-5-3-4-6-14(13)16/h3-11H,19H2,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43292
PNG
(2,5-dimethoxy-N-(5-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1cccc2c(O)cccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-12-9-10-17(24-2)18(11-12)25(21,22)19-15-7-3-6-14-13(15)5-4-8-16(14)20/h3-11,19-20H,1-2H3
PDB
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)		BDBM43295
PNG
(N-(2-hydroxyphenyl)-2,5-dimethoxy-benzenesulfonami...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccccc1O
Show InChI InChI=1S/C14H15NO5S/c1-19-10-7-8-13(20-2)14(9-10)21(17,18)15-11-5-3-4-6-12(11)16/h3-9,15-16H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q25B00VT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%