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Compile Data Set for Download or QSAR

Found 29 hits Enz. Inhib. hit(s) with Target = 'Retina-specific amine oxidase, copper containing' AND taxid = 9606   
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
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022534
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-3-5-11(6-4-10)15-7-1-2-8-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022539
PNG
((3-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1cccc(c1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-4-3-5-11(8-10)15-6-1-2-7-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022533
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid isopropylidene-...)
Show SMILES CC(C)=NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C15H17N3O/c1-12(2)16-17-15(19)11-13-5-7-14(8-6-13)18-9-3-4-10-18/h3-10H,11H2,1-2H3,(H,17,19)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022539
PNG
((3-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1cccc(c1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-4-3-5-11(8-10)15-6-1-2-7-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022539
PNG
((3-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1cccc(c1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-4-3-5-11(8-10)15-6-1-2-7-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022534
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-3-5-11(6-4-10)15-7-1-2-8-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022533
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid isopropylidene-...)
Show SMILES CC(C)=NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C15H17N3O/c1-12(2)16-17-15(19)11-13-5-7-14(8-6-13)18-9-3-4-10-18/h3-10H,11H2,1-2H3,(H,17,19)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022534
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-3-5-11(6-4-10)15-7-1-2-8-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022539
PNG
((3-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1cccc(c1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-4-3-5-11(8-10)15-6-1-2-7-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022533
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid isopropylidene-...)
Show SMILES CC(C)=NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C15H17N3O/c1-12(2)16-17-15(19)11-13-5-7-14(8-6-13)18-9-3-4-10-18/h3-10H,11H2,1-2H3,(H,17,19)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022533
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid isopropylidene-...)
Show SMILES CC(C)=NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C15H17N3O/c1-12(2)16-17-15(19)11-13-5-7-14(8-6-13)18-9-3-4-10-18/h3-10H,11H2,1-2H3,(H,17,19)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022534
PNG
((4-Pyrrol-1-yl-phenyl)-acetic acid hydrazide | CHE...)
Show SMILES NNC(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C12H13N3O/c13-14-12(16)9-10-3-5-11(6-4-10)15-7-1-2-8-15/h1-8H,9,13H2,(H,14,16)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022536
PNG
(4-Pyrrol-1-yl-benzoic acid hydrazide | 4-pyrrol-1-...)
Show SMILES NNC(=O)c1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-3-5-10(6-4-9)14-7-1-2-8-14/h1-8H,12H2,(H,13,15)
KEGG

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n/an/a 5.00E+3n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022537
PNG
(3-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16721...)
Show SMILES NNC(=O)c1cccc(c1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-4-3-5-10(8-9)14-6-1-2-7-14/h1-8H,12H2,(H,13,15)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022537
PNG
(3-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16721...)
Show SMILES NNC(=O)c1cccc(c1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-4-3-5-10(8-9)14-6-1-2-7-14/h1-8H,12H2,(H,13,15)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50384084
PNG
(CHEMBL2029546)
Show SMILES NC\C=C(\F)COc1ccc(cc1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C17H23FN2O2/c18-14(10-11-19)12-22-16-8-6-13(7-9-16)17(21)20-15-4-2-1-3-5-15/h6-10,15H,1-5,11-12,19H2,(H,20,21)/b14-10+
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n/an/a>1.00E+4n/an/an/an/an/an/a



Pharmaxis Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human AOC2


Citation and Details
More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022535
PNG
(CHEMBL167153 | [4-(2,5-Dimethyl-pyrrol-1-yl)-pheny...)
Show SMILES Cc1ccc(C)n1-c1ccc(CC(=O)NN)cc1
Show InChI InChI=1S/C14H17N3O/c1-10-3-4-11(2)17(10)13-7-5-12(6-8-13)9-14(18)16-15/h3-8H,9,15H2,1-2H3,(H,16,18)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022535
PNG
(CHEMBL167153 | [4-(2,5-Dimethyl-pyrrol-1-yl)-pheny...)
Show SMILES Cc1ccc(C)n1-c1ccc(CC(=O)NN)cc1
Show InChI InChI=1S/C14H17N3O/c1-10-3-4-11(2)17(10)13-7-5-12(6-8-13)9-14(18)16-15/h3-8H,9,15H2,1-2H3,(H,16,18)
KEGG

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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022535
PNG
(CHEMBL167153 | [4-(2,5-Dimethyl-pyrrol-1-yl)-pheny...)
Show SMILES Cc1ccc(C)n1-c1ccc(CC(=O)NN)cc1
Show InChI InChI=1S/C14H17N3O/c1-10-3-4-11(2)17(10)13-7-5-12(6-8-13)9-14(18)16-15/h3-8H,9,15H2,1-2H3,(H,16,18)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022536
PNG
(4-Pyrrol-1-yl-benzoic acid hydrazide | 4-pyrrol-1-...)
Show SMILES NNC(=O)c1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-3-5-10(6-4-9)14-7-1-2-8-14/h1-8H,12H2,(H,13,15)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022535
PNG
(CHEMBL167153 | [4-(2,5-Dimethyl-pyrrol-1-yl)-pheny...)
Show SMILES Cc1ccc(C)n1-c1ccc(CC(=O)NN)cc1
Show InChI InChI=1S/C14H17N3O/c1-10-3-4-11(2)17(10)13-7-5-12(6-8-13)9-14(18)16-15/h3-8H,9,15H2,1-2H3,(H,16,18)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022536
PNG
(4-Pyrrol-1-yl-benzoic acid hydrazide | 4-pyrrol-1-...)
Show SMILES NNC(=O)c1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-3-5-10(6-4-9)14-7-1-2-8-14/h1-8H,12H2,(H,13,15)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022536
PNG
(4-Pyrrol-1-yl-benzoic acid hydrazide | 4-pyrrol-1-...)
Show SMILES NNC(=O)c1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-3-5-10(6-4-9)14-7-1-2-8-14/h1-8H,12H2,(H,13,15)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022537
PNG
(3-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16721...)
Show SMILES NNC(=O)c1cccc(c1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-4-3-5-10(8-9)14-6-1-2-7-14/h1-8H,12H2,(H,13,15)
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Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022537
PNG
(3-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16721...)
Show SMILES NNC(=O)c1cccc(c1)-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-4-3-5-10(8-9)14-6-1-2-7-14/h1-8H,12H2,(H,13,15)
KEGG

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n/an/a 1.00E+5n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022538
PNG
(2-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16726...)
Show SMILES NNC(=O)c1ccccc1-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-5-1-2-6-10(9)14-7-3-4-8-14/h1-8H,12H2,(H,13,15)
KEGG

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n/an/a 3.00E+5n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 15 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022538
PNG
(2-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16726...)
Show SMILES NNC(=O)c1ccccc1-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-5-1-2-6-10(9)14-7-3-4-8-14/h1-8H,12H2,(H,13,15)
KEGG

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n/an/a 3.00E+5n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 60 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022538
PNG
(2-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16726...)
Show SMILES NNC(=O)c1ccccc1-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-5-1-2-6-10(9)14-7-3-4-8-14/h1-8H,12H2,(H,13,15)
KEGG

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n/an/a 3.00E+5n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 0 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair
Retina-specific amine oxidase, copper containing


(Homo sapiens)
BDBM50022538
PNG
(2-Pyrrol-1-yl-benzoic acid hydrazide | CHEMBL16726...)
Show SMILES NNC(=O)c1ccccc1-n1cccc1
Show InChI InChI=1S/C11H11N3O/c12-13-11(15)9-5-1-2-6-10(9)14-7-3-4-8-14/h1-8H,12H2,(H,13,15)
KEGG

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antibodypedia
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CHEMBL
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PubMed
n/an/a 3.00E+5n/an/an/an/an/an/a



Università di Roma "La Sapienza"

Curated by ChEMBL


Assay Description
Effect on plasma amine oxidase (0.1 uM) after 30 min of incubation at pH 7.2


J Med Chem 31: 802-6 (1988)

More data for this
Ligand-Target Pair