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Compile Data Set for Download or QSAR

Found 26 hits Enz. Inhib. hit(s) with Target = '8-Oxoguanine DNA glycosylase-1 (OGG1)'   
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
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163679
PNG
(3,4‐Dichloro‐1‐benzothiophene...)
Show SMILES NNC(=O)c1sc2cccc(Cl)c2c1Cl
Show InChI InChI=1S/C9H6Cl2N2OS/c10-4-2-1-3-5-6(4)7(11)8(15-5)9(14)13-12/h1-3H,12H2,(H,13,14)
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n/an/a 220n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163680
PNG
(3‐Chloro‐N'‐[(1Z)‐2...)
Show SMILES CC1CCCC\C1=N\NC(=O)c1sc2ccccc2c1Cl
Show InChI InChI=1/C16H17ClN2OS/c1-10-6-2-4-8-12(10)18-19-16(20)15-14(17)11-7-3-5-9-13(11)21-15/h3,5,7,9-10H,2,4,6,8H2,1H3,(H,19,20)/b18-12-
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n/an/a 270n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163683
PNG
(N'‐Cyclohexylidene‐3‐hydroxy...)
Show SMILES Oc1cc2ccccc2cc1C(=O)NN=C1CCCCC1
Show InChI InChI=1S/C17H18N2O2/c20-16-11-13-7-5-4-6-12(13)10-15(16)17(21)19-18-14-8-2-1-3-9-14/h4-7,10-11,20H,1-3,8-9H2,(H,19,21)
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n/an/a 290n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163694
PNG
(3‐Chloro‐1‐benzothiophene‐...)
Show SMILES NNC(=O)c1sc2ccccc2c1Cl
Show InChI InChI=1S/C9H7ClN2OS/c10-7-5-3-1-2-4-6(5)14-8(7)9(13)12-11/h1-4H,11H2,(H,12,13)
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n/an/a 300n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163681
PNG
(3-Chloro‐N'‐[(1E)‐(4‐f...)
Show SMILES Fc1ccc(\C=N\NC(=O)c2sc3ccccc3c2Cl)cc1
Show InChI InChI=1S/C16H10ClFN2OS/c17-14-12-3-1-2-4-13(12)22-15(14)16(21)20-19-9-10-5-7-11(18)8-6-10/h1-9H,(H,20,21)/b19-9+
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n/an/a 330n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163683
PNG
(N'‐Cyclohexylidene‐3‐hydroxy...)
Show SMILES Oc1cc2ccccc2cc1C(=O)NN=C1CCCCC1
Show InChI InChI=1S/C17H18N2O2/c20-16-11-13-7-5-4-6-12(13)10-15(16)17(21)19-18-14-8-2-1-3-9-14/h4-7,10-11,20H,1-3,8-9H2,(H,19,21)
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Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163679
PNG
(3,4‐Dichloro‐1‐benzothiophene...)
Show SMILES NNC(=O)c1sc2cccc(Cl)c2c1Cl
Show InChI InChI=1S/C9H6Cl2N2OS/c10-4-2-1-3-5-6(4)7(11)8(15-5)9(14)13-12/h1-3H,12H2,(H,13,14)
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Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163680
PNG
(3‐Chloro‐N'‐[(1Z)‐2...)
Show SMILES CC1CCCC\C1=N\NC(=O)c1sc2ccccc2c1Cl
Show InChI InChI=1/C16H17ClN2OS/c1-10-6-2-4-8-12(10)18-19-16(20)15-14(17)11-7-3-5-9-13(11)21-15/h3,5,7,9-10H,2,4,6,8H2,1H3,(H,19,20)/b18-12-
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n/an/a 370n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163695
PNG
(Benzoylhydrazine, P‐bromo (0151-Hy))
Show SMILES NNC(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C7H7BrN2O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,9H2,(H,10,11)
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n/an/a 390n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163681
PNG
(3-Chloro‐N'‐[(1E)‐(4‐f...)
Show SMILES Fc1ccc(\C=N\NC(=O)c2sc3ccccc3c2Cl)cc1
Show InChI InChI=1S/C16H10ClFN2OS/c17-14-12-3-1-2-4-13(12)22-15(14)16(21)20-19-9-10-5-7-11(18)8-6-10/h1-9H,(H,20,21)/b19-9+
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n/an/a 420n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163682
PNG
(4‐Bromo‐N'‐cyclohexylidenebe...)
Show SMILES Brc1ccc(cc1)C(=O)NN=C1CCCCC1
Show InChI InChI=1S/C13H15BrN2O/c14-11-8-6-10(7-9-11)13(17)16-15-12-4-2-1-3-5-12/h6-9H,1-5H2,(H,16,17)
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n/an/a 610n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163682
PNG
(4‐Bromo‐N'‐cyclohexylidenebe...)
Show SMILES Brc1ccc(cc1)C(=O)NN=C1CCCCC1
Show InChI InChI=1S/C13H15BrN2O/c14-11-8-6-10(7-9-11)13(17)16-15-12-4-2-1-3-5-12/h6-9H,1-5H2,(H,16,17)
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n/an/a 630n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163685
PNG
(2‐(4‐Chloro‐3,5‐dimethylph...)
Show SMILES Cc1cc(OCC(=O)NN)cc(C)c1Cl
Show InChI InChI=1S/C10H13ClN2O2/c1-6-3-8(4-7(2)10(6)11)15-5-9(14)13-12/h3-4H,5,12H2,1-2H3,(H,13,14)
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n/an/a 1.53E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163686
PNG
(2‐(Naphthalen‐1‐yloxy)acetohydra...)
Show SMILES NNC(=O)COc1cccc2ccccc12
Show InChI InChI=1S/C12H12N2O2/c13-14-12(15)8-16-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8,13H2,(H,14,15)
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n/an/a 1.56E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163690
PNG
(3‐Bromo‐N'‐[(2Z)‐hexan...)
Show SMILES CCCC\C(C)=N/NC(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H17BrN2O/c1-3-4-6-10(2)15-16-13(17)11-7-5-8-12(14)9-11/h5,7-9H,3-4,6H2,1-2H3,(H,16,17)/b15-10-
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n/an/a 2.13E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163684
PNG
(2‐(3‐Chlorophenoxy)propanehydrazide (0...)
Show SMILES CC(Oc1cccc(Cl)c1)C(=O)NN
Show InChI InChI=1/C9H11ClN2O2/c1-6(9(13)12-11)14-8-4-2-3-7(10)5-8/h2-6H,11H2,1H3,(H,12,13)
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n/an/a 3.38E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163689
PNG
(3‐Bromo‐N'‐[(2Z)‐hex&#...)
Show SMILES C\C(CCC=C)=N\NC(=O)c1cccc(Br)c1
Show InChI InChI=1S/C13H15BrN2O/c1-3-4-6-10(2)15-16-13(17)11-7-5-8-12(14)9-11/h3,5,7-9H,1,4,6H2,2H3,(H,16,17)/b15-10-
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n/an/a 3.78E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163691
PNG
(1‐(4‐Methoxy‐2,5‐dimethylb...)
Show SMILES COc1cc(C)c(cc1C)S(=O)(=O)n1cc(C)nc1-c1ccccc1
Show InChI InChI=1S/C19H20N2O3S/c1-13-11-18(14(2)10-17(13)24-4)25(22,23)21-12-15(3)20-19(21)16-8-6-5-7-9-16/h5-12H,1-4H3
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n/an/a 4.15E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163688
PNG
(2,4‐Dichloro‐N'‐(1‐pro...)
Show SMILES CCCN1CCC(CC1)=NNC(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C15H19Cl2N3O/c1-2-7-20-8-5-12(6-9-20)18-19-15(21)13-4-3-11(16)10-14(13)17/h3-4,10H,2,5-9H2,1H3,(H,19,21)
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n/an/a 4.56E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163687
PNG
(N'‐[(1E)‐1‐(2H‐1,3R...)
Show SMILES C\C(=N/NC(=O)c1cc2ccccc2cc1O)c1ccc2OCOc2c1
Show InChI InChI=1S/C20H16N2O4/c1-12(13-6-7-18-19(10-13)26-11-25-18)21-22-20(24)16-8-14-4-2-3-5-15(14)9-17(16)23/h2-10,23H,11H2,1H3,(H,22,24)/b21-12+
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n/an/a 7.17E+3n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM50106186
PNG
(4‐Bromobenzamide (0151-Am) | 4-Bromo-benzami...)
Show SMILES NC(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C7H6BrNO/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H2,9,10)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM50336507
PNG
(4-pyridinecarbohydrazide(Isoniazid) | CHEMBL64 | D...)
Show SMILES NNC(=O)c1ccncc1
Show InChI InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM50336507
PNG
(4-pyridinecarbohydrazide(Isoniazid) | CHEMBL64 | D...)
Show SMILES NNC(=O)c1ccncc1
Show InChI InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
Gel-based assays were performed by combining 4 無 of OGG1 (62.5 nM) with 1 無 of inhibitor or buffer. Substrate (5 無, 50 nM) was added to bring the ...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM81461
PNG
(CAS_86-54-4 | Hydralazine | Hydralazine (HZN) | NS...)
Show SMILES NNc1nncc2ccccc12
Show InChI InChI=1S/C8H8N4/c9-11-8-7-4-2-1-3-6(7)5-10-12-8/h1-5H,9H2,(H,11,12)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
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Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163692
PNG
(Isocarboxazid (ICD))
Show SMILES Cc1cc(no1)C(=O)NNCc1ccccc1
Show InChI InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)
PDB

KEGG

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



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair
8-Oxoguanine DNA glycosylase-1 (OGG1)


(Homo sapiens (Human))
BDBM163693
PNG
(Nialamide)
Show SMILES O=C(CCNNC(=O)c1ccncc1)NCc1ccccc1
Show InChI InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22)
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
PC cid
PC sid
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AffyNet 
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Oregon Health & Science University



Assay Description
A total of 4 無 of OGG1 (125 nM) was mixed with 1 無 of inhibitor. In a separate tube, 1 無 of freshly prepared 10 mM NaBH3CN (diluted in H2O) was mi...


Citation and Details
More data for this
Ligand-Target Pair