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PubMed code 6298428

Compile data set for download or QSAR
Found 28 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
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027613
PNG
(1-(3-Acetylsulfanyl-4-biphenyl-4-yl-4-oxo-butyryl)...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C23H23NO5S/c1-15(25)30-20(14-21(26)24-13-5-8-19(24)23(28)29)22(27)18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-4,6-7,9-12,19-20H,5,8,13-14H2,1H3,(H,28,29)
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n/an/a 86n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027608
PNG
(1-[3-Acetylsulfanyl-4-oxo-4-(3-trifluoromethyl-phe...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C18H18F3NO5S/c1-10(23)28-14(9-15(24)22-7-3-6-13(22)17(26)27)16(25)11-4-2-5-12(8-11)18(19,20)21/h2,4-5,8,13-14H,3,6-7,9H2,1H3,(H,26,27)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027628
PNG
(1-[3-Benzoylsulfanyl-4-(4-bromo-phenyl)-4-oxo-buty...)
Show SMILES OC(=O)C1CCCN1C(=O)CC(SC(=O)c1ccccc1)C(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C22H20BrNO5S/c23-16-10-8-14(9-11-16)20(26)18(30-22(29)15-5-2-1-3-6-15)13-19(25)24-12-4-7-17(24)21(27)28/h1-3,5-6,8-11,17-18H,4,7,12-13H2,(H,27,28)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027629
PNG
(1-[3-Acetylsulfanyl-4-(4-bromo-phenyl)-4-oxo-butyr...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C17H18BrNO5S/c1-10(20)25-14(16(22)11-4-6-12(18)7-5-11)9-15(21)19-8-2-3-13(19)17(23)24/h4-7,13-14H,2-3,8-9H2,1H3,(H,23,24)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027610
PNG
(1-(3-Acetylsulfanyl-4-naphthalen-2-yl-4-oxo-butyry...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C21H21NO5S/c1-13(23)28-18(12-19(24)22-10-4-7-17(22)21(26)27)20(25)16-9-8-14-5-2-3-6-15(14)11-16/h2-3,5-6,8-9,11,17-18H,4,7,10,12H2,1H3,(H,26,27)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027619
PNG
(1-[3-Acetylsulfanyl-4-(4-bromo-phenyl)-2-methyl-4-...)
Show SMILES C[C@H]([C@H](SC(C)=O)C(=O)c1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20BrNO5S/c1-10(17(23)20-9-3-4-14(20)18(24)25)16(26-11(2)21)15(22)12-5-7-13(19)8-6-12/h5-8,10,14,16H,3-4,9H2,1-2H3,(H,24,25)/t10-,14+,16+/m1/s1
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM21642
PNG
((2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolid...)
Show SMILES C[C@H](CS)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1
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n/an/a 156n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027605
PNG
(1-[3-Benzoylsulfanyl-4-(3-fluoro-phenyl)-4-oxo-but...)
Show SMILES OC(=O)C1CCCN1C(=O)CC(SC(=O)c1ccccc1)C(=O)c1cccc(F)c1
Show InChI InChI=1S/C22H20FNO5S/c23-16-9-4-8-15(12-16)20(26)18(30-22(29)14-6-2-1-3-7-14)13-19(25)24-11-5-10-17(24)21(27)28/h1-4,6-9,12,17-18H,5,10-11,13H2,(H,27,28)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027612
PNG
(1-[3-Acetylsulfanyl-4-(4-tert-butyl-phenyl)-4-oxo-...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO5S/c1-13(23)28-17(12-18(24)22-11-5-6-16(22)20(26)27)19(25)14-7-9-15(10-8-14)21(2,3)4/h7-10,16-17H,5-6,11-12H2,1-4H3,(H,26,27)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027606
PNG
(1-(3-Acetylsulfanyl-4-indan-5-yl-4-oxo-butyryl)-py...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc2CCCc2c1
Show InChI InChI=1S/C20H23NO5S/c1-12(22)27-17(11-18(23)21-9-3-6-16(21)20(25)26)19(24)15-8-7-13-4-2-5-14(13)10-15/h7-8,10,16-17H,2-6,9,11H2,1H3,(H,25,26)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027620
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-phenyl)-2-methyl-4...)
Show SMILES C[C@H]([C@H](SC(C)=O)C(=O)c1cccc(F)c1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20FNO5S/c1-10(17(23)20-8-4-7-14(20)18(24)25)16(26-11(2)21)15(22)12-5-3-6-13(19)9-12/h3,5-6,9-10,14,16H,4,7-8H2,1-2H3,(H,24,25)/t10-,14+,16+/m1/s1
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027607
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-phenyl)-4-oxo-buty...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1cccc(F)c1
Show InChI InChI=1S/C17H18FNO5S/c1-10(20)25-14(16(22)11-4-2-5-12(18)8-11)9-15(21)19-7-3-6-13(19)17(23)24/h2,4-5,8,13-14H,3,6-7,9H2,1H3,(H,23,24)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027603
PNG
(1-[4-(4-Bromo-phenyl)-3-mercapto-4-oxo-butyryl]-py...)
Show SMILES OC(C(=S)CC(=O)N1CCCC1C(O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C15H16BrNO4S/c16-10-5-3-9(4-6-10)14(19)12(22)8-13(18)17-7-1-2-11(17)15(20)21/h3-6,11,14,19H,1-2,7-8H2,(H,20,21)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027618
PNG
(1-[3-Benzoylsulfanyl-4-(4-fluoro-phenyl)-4-oxo-but...)
Show SMILES OC(=O)C1CCCN1C(=O)CC(SC(=O)c1ccccc1)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C22H20FNO5S/c23-16-10-8-14(9-11-16)20(26)18(30-22(29)15-5-2-1-3-6-15)13-19(25)24-12-4-7-17(24)21(27)28/h1-3,5-6,8-11,17-18H,4,7,12-13H2,(H,27,28)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027626
PNG
(1-{3-Acetylsulfanyl-4-[4-(4-chloro-phenoxy)-phenyl...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(Oc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H22ClNO6S/c1-14(26)32-20(13-21(27)25-12-2-3-19(25)23(29)30)22(28)15-4-8-17(9-5-15)31-18-10-6-16(24)7-11-18/h4-11,19-20H,2-3,12-13H2,1H3,(H,29,30)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027609
PNG
(1-[3-Acetylsulfanyl-4-(4-chloro-phenyl)-2-methyl-4...)
Show SMILES CC(C(SC(C)=O)C(=O)c1ccc(Cl)cc1)C(=O)N1CCCC1C(O)=O
Show InChI InChI=1S/C18H20ClNO5S/c1-10(17(23)20-9-3-4-14(20)18(24)25)16(26-11(2)21)15(22)12-5-7-13(19)8-6-12/h5-8,10,14,16H,3-4,9H2,1-2H3,(H,24,25)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027614
PNG
(1-(3-Acetylsulfanyl-4-oxo-4-phenyl-butyryl)-pyrrol...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccccc1
Show InChI InChI=1S/C17H19NO5S/c1-11(19)24-14(16(21)12-6-3-2-4-7-12)10-15(20)18-9-5-8-13(18)17(22)23/h2-4,6-7,13-14H,5,8-10H2,1H3,(H,22,23)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027624
PNG
(1-[3-Acetylsulfanyl-4-(4-fluoro-phenyl)-4-oxo-buty...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H18FNO5S/c1-10(20)25-14(16(22)11-4-6-12(18)7-5-11)9-15(21)19-8-2-3-13(19)17(23)24/h4-7,13-14H,2-3,8-9H2,1H3,(H,23,24)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027611
PNG
(1-(3-Benzoylsulfanyl-4-oxo-4-phenyl-butyryl)-pyrro...)
Show SMILES OC(=O)C1CCCN1C(=O)CC(SC(=O)c1ccccc1)C(=O)c1ccccc1
Show InChI InChI=1S/C22H21NO5S/c24-19(23-13-7-12-17(23)21(26)27)14-18(20(25)15-8-3-1-4-9-15)29-22(28)16-10-5-2-6-11-16/h1-6,8-11,17-18H,7,12-14H2,(H,26,27)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027623
PNG
(1-(3-Acetylsulfanyl-2-methyl-4-oxo-4-phenyl-butyry...)
Show SMILES C[C@H]([C@@H](SC(C)=O)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-11(17(22)19-10-6-9-14(19)18(23)24)16(25-12(2)20)15(21)13-7-4-3-5-8-13/h3-5,7-8,11,14,16H,6,9-10H2,1-2H3,(H,23,24)/t11-,14+,16-/m1/s1
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027617
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-4-methoxy-phenyl)-...)
Show SMILES COc1ccc(cc1F)C(=O)C(CC(=O)N1CCCC1C(O)=O)SC(C)=O
Show InChI InChI=1S/C18H20FNO6S/c1-10(21)27-15(9-16(22)20-7-3-4-13(20)18(24)25)17(23)11-5-6-14(26-2)12(19)8-11/h5-6,8,13,15H,3-4,7,9H2,1-2H3,(H,24,25)
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027627
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-phenyl)-2-methyl-4...)
Show SMILES C[C@H]([C@@H](SC(C)=O)C(=O)c1cccc(F)c1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20FNO5S/c1-10(17(23)20-8-4-7-14(20)18(24)25)16(26-11(2)21)15(22)12-5-3-6-13(19)9-12/h3,5-6,9-10,14,16H,4,7-8H2,1-2H3,(H,24,25)/t10-,14+,16-/m1/s1
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n/an/a 617n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027615
PNG
(1-(3-Acetylsulfanyl-2-methyl-4-oxo-4-phenyl-butyry...)
Show SMILES C[C@H]([C@H](SC(C)=O)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H21NO5S/c1-11(17(22)19-10-6-9-14(19)18(23)24)16(25-12(2)20)15(21)13-7-4-3-5-8-13/h3-5,7-8,11,14,16H,6,9-10H2,1-2H3,(H,23,24)/t11-,14+,16+/m1/s1
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TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027616
PNG
(1-[3-Acetylsulfanyl-4-(4-chloro-phenyl)-4-oxo-buty...)
Show SMILES CC(=O)SC(CC(=O)N1CCCC1C(O)=O)C(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H18ClNO5S/c1-10(20)25-14(16(22)11-4-6-12(18)7-5-11)9-15(21)19-8-2-3-13(19)17(23)24/h4-7,13-14H,2-3,8-9H2,1H3,(H,23,24)
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n/an/a 825n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027625
PNG
(1-(3-Acetylsulfanyl-2-methyl-4-naphthalen-1-yl-4-o...)
Show SMILES C[C@@H]([C@H](SC(C)=O)C(=O)c1cccc2ccccc12)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C22H23NO5S/c1-13(21(26)23-12-6-11-18(23)22(27)28)20(29-14(2)24)19(25)17-10-5-8-15-7-3-4-9-16(15)17/h3-5,7-10,13,18,20H,6,11-12H2,1-2H3,(H,27,28)/t13-,18-,20-/m0/s1
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n/an/a 830n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027604
PNG
(1-[3-Acetylsulfanyl-4-(4-bromo-phenyl)-2-methyl-4-...)
Show SMILES C[C@H]([C@@H](SC(C)=O)C(=O)c1ccc(Br)cc1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20BrNO5S/c1-10(17(23)20-9-3-4-14(20)18(24)25)16(26-11(2)21)15(22)12-5-7-13(19)8-6-12/h5-8,10,14,16H,3-4,9H2,1-2H3,(H,24,25)/t10-,14+,16-/m1/s1
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n/an/a 985n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027622
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-phenyl)-2-methyl-4...)
Show SMILES C[C@@H]([C@@H](SC(C)=O)C(=O)c1cccc(F)c1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20FNO5S/c1-10(17(23)20-8-4-7-14(20)18(24)25)16(26-11(2)21)15(22)12-5-3-6-13(19)9-12/h3,5-6,9-10,14,16H,4,7-8H2,1-2H3,(H,24,25)/t10-,14-,16+/m0/s1
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n/an/a 1.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
Angiotensin-converting enzyme


(Rattus norvegicus)		BDBM50027621
PNG
(1-[3-Acetylsulfanyl-4-(3-fluoro-phenyl)-2-methyl-4...)
Show SMILES C[C@@H]([C@H](SC(C)=O)C(=O)c1cccc(F)c1)C(=O)N1CCC[C@H]1C(O)=O
Show InChI InChI=1S/C18H20FNO5S/c1-10(17(23)20-8-4-7-14(20)18(24)25)16(26-11(2)21)15(22)12-5-3-6-13(19)9-12/h3,5-6,9-10,14,16H,4,7-8H2,1-2H3,(H,24,25)/t10-,14-,16-/m0/s1
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n/an/a 2.80E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antihypertensive activity determined by inhibition of angiotensin I converting enzyme

J Med Chem 26: 381-93 (1983)


BindingDB Entry DOI: 10.7270/Q2XS5VZQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%