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PubMed code 8978837

Compile data set for download or QSAR
Found 60 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
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055189
PNG
((3-Acetylamino-phenyl)-trimethyl-ammonium; bromide...)
Show SMILES CC(=O)Nc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C11H16N2O/c1-9(14)12-10-6-5-7-11(8-10)13(2,3)4/h5-8H,1-4H3/p+1
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n/an/a 1n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055173
PNG
(CHEMBL148522 | Dimethyl-pent-4-enyl-ammonium; brom...)
Show SMILES C[NH+](C)CCCC=C
Show InChI InChI=1S/C7H15N/c1-4-5-6-7-8(2)3/h4H,1,5-7H2,2-3H3/p+1
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n/an/a 1.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50014109
PNG
((-)-Octyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCCCCCNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C22H35N3O2/c1-5-6-7-8-9-10-14-23-21(26)27-17-11-12-19-18(16-17)22(2)13-15-24(3)20(22)25(19)4/h11-12,16,20H,5-10,13-15H2,1-4H3,(H,23,26)/t20-,22+/m1/s1
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n/an/a 1.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055161
PNG
((S)-2-(4-Cyano-phenyl)-2-hydroxy-4,4-dimethyl-morp...)
Show SMILES C[N+]1(C)CCO[C@](O)(C1)c1ccc(cc1)C#N
Show InChI InChI=1S/C13H17N2O2/c1-15(2)7-8-17-13(16,10-15)12-5-3-11(9-14)4-6-12/h3-6,16H,7-8,10H2,1-2H3/q+1/t13-/m1/s1
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n/an/a 1.20n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055206
PNG
((3-Methoxy-4-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES COc1cc(ccc1C)[N+](C)(C)C
Show InChI InChI=1S/C11H18NO/c1-9-6-7-10(12(2,3)4)8-11(9)13-5/h6-8H,1-5H3/q+1
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n/an/a 1.20n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055211
PNG
((2-Ethoxy-ethyl)-trimethyl-ammonium; iodide | CHEM...)
Show SMILES CCOCC[N+](C)(C)C
Show InChI InChI=1S/C7H18NO/c1-5-9-7-6-8(2,3)4/h5-7H2,1-4H3/q+1
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University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM8978
PNG
((Propylcarbonylthioethyl)trimethylammonium iodide ...)
Show SMILES CCCC(=O)SCC[N+](C)(C)C
Show InChI InChI=1S/C9H20NOS/c1-5-6-9(11)12-8-7-10(2,3)4/h5-8H2,1-4H3/q+1
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n/an/a 1.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055163
PNG
((3-Hydroxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES Cc1c(O)cccc1[N+](C)(C)C
Show InChI InChI=1S/C10H15NO/c1-8-9(11(2,3)4)6-5-7-10(8)12/h5-7H,1-4H3/p+1
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n/an/a 1.40n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055207
PNG
((S)-5-Butylcarbamoyloxy-1,3a,8-trimethyl-1,2,3,3a,...)
Show SMILES CCCCNC(=O)Oc1ccc2N(C)C3[N@H+](C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C18H27N3O2/c1-5-6-10-19-17(22)23-13-7-8-15-14(12-13)18(2)9-11-20(3)16(18)21(15)4/h7-8,12,16H,5-6,9-11H2,1-4H3,(H,19,22)/p+1/t16?,18-/m0/s1
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n/an/a 1.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055209
PNG
((2-Ethylsulfanyl-ethyl)-trimethyl-ammonium; iodide...)
Show SMILES CCSCC[N+](C)(C)C
Show InChI InChI=1S/C7H18NS/c1-5-9-7-6-8(2,3)4/h5-7H2,1-4H3/q+1
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n/an/a 1.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055168
PNG
((S)-2-Hydroxy-2,4,4-trimethyl-morpholin-4-ium; bro...)
Show SMILES C[C@@]1(O)C[N+](C)(C)CCO1
Show InChI InChI=1S/C7H16NO2/c1-7(9)6-8(2,3)4-5-10-7/h9H,4-6H2,1-3H3/q+1/t7-/m0/s1
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n/an/a 1.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50014107
PNG
((-)-(4-Methoxy-phenyl)-carbamic acid 1,3a,8-trimet...)
Show SMILES COc1ccc(NC(=O)Oc2ccc3N(C)[C@H]4N(C)CC[C@@]4(C)c3c2)cc1
Show InChI InChI=1S/C21H25N3O3/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)27-20(25)22-14-5-7-15(26-4)8-6-14/h5-10,13,19H,11-12H2,1-4H3,(H,22,25)/t19-,21+/m1/s1
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n/an/a 1.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055208
PNG
((S)-2-Hydroxy-4,4-dimethyl-morpholin-4-ium; chlori...)
Show SMILES C[N+]1(C)CCO[C@H](O)C1
Show InChI InChI=1S/C6H14NO2/c1-7(2)3-4-9-6(8)5-7/h6,8H,3-5H2,1-2H3/q+1/t6-/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055181
PNG
((S)-5-(4-Chloro-phenylcarbamoyloxy)-1,3a,8-trimeth...)
Show SMILES CN1C2[N@H+](C)CC[C@@]2(C)c2cc(OC(=O)Nc3ccc(Cl)cc3)ccc12
Show InChI InChI=1S/C20H22ClN3O2/c1-20-10-11-23(2)18(20)24(3)17-9-8-15(12-16(17)20)26-19(25)22-14-6-4-13(21)5-7-14/h4-9,12,18H,10-11H2,1-3H3,(H,22,25)/p+1/t18?,20-/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055172
PNG
((3-Hydroxy-2-methyl-phenyl)-trimethyl-ammonium | 1...)
Show SMILES C[N+](C)(C)c1cccc([NH3+])c1
Show InChI InChI=1S/C9H15N2/c1-11(2,3)9-6-4-5-8(10)7-9/h4-7H,10H2,1-3H3/q+1/p+1
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n/an/a 1.90n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055198
PNG
((S)-2-(4-Acetylamino-phenyl)-2-hydroxy-4,4-dimethy...)
Show SMILES CC(=O)Nc1ccc(cc1)[C@@]1(O)C[N+](C)(C)CCO1
Show InChI InChI=1S/C14H20N2O3/c1-11(17)15-13-6-4-12(5-7-13)14(18)10-16(2,3)8-9-19-14/h4-7,18H,8-10H2,1-3H3/p+1/t14-/m1/s1
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n/an/a 2.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055201
PNG
((2-Butyryloxy-ethyl)-trimethyl-ammonium; iodide | ...)
Show SMILES CCCC(=O)OCC[N+](C)(C)C
Show InChI InChI=1S/C9H20NO2/c1-5-6-9(11)12-8-7-10(2,3)4/h5-8H2,1-4H3/q+1
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n/an/a 2.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055162
PNG
((3-Methoxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES COc1cccc(c1C)[N+](C)(C)C
Show InChI InChI=1S/C11H18NO/c1-9-10(12(2,3)4)7-6-8-11(9)13-5/h6-8H,1-5H3/q+1
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n/an/a 2.40n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055170
PNG
((2-Chloro-ethyl)-trimethyl-ammonium; chloride | CH...)
Show SMILES C[N+](C)(C)CCCl
Show InChI InChI=1S/C5H13ClN/c1-7(2,3)5-4-6/h4-5H2,1-3H3/q+1
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University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055185
PNG
((5-Hydroxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES Cc1ccc(O)cc1[N+](C)(C)C
Show InChI InChI=1S/C10H15NO/c1-8-5-6-9(12)7-10(8)11(2,3)4/h5-7H,1-4H3/p+1
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n/an/a 2.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055165
PNG
(Allyl-trimethyl-ammonium; bromide | CHEMBL135503 |...)
Show SMILES C[N+](C)(C)CC=C
Show InChI InChI=1S/C6H14N/c1-5-6-7(2,3)4/h5H,1,6H2,2-4H3/q+1
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n/an/a 2.90n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055199
PNG
((3-Acetoxy-phenyl)-trimethyl-ammonium | CHEMBL3433...)
Show SMILES CC(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C11H16NO2/c1-9(13)14-11-7-5-6-10(8-11)12(2,3)4/h5-8H,1-4H3/q+1
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n/an/a 3n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50026220
PNG
(2-hydroxy-N,N,N-trimethylethanaminium | CHEMBL2824...)
Show SMILES C[N+](C)(C)CCO
Show InChI InChI=1S/C5H14NO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
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n/an/a 3n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055204
PNG
((3-Hydroxy-4-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES Cc1ccc(cc1O)[N+](C)(C)C
Show InChI InChI=1S/C10H15NO/c1-8-5-6-9(7-10(8)12)11(2,3)4/h5-7H,1-4H3/p+1
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n/an/a 3.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50321916
PNG
((3aS)-1,1,3a,8-tetramethyl-5-(methylcarbamoyloxy)-...)
Show SMILES CNC(=O)Oc1ccc2N(C)C3[C@@](C)(CC[N+]3(C)C)c2c1
Show InChI InChI=1S/C16H23N3O2/c1-16-8-9-19(4,5)14(16)18(3)13-7-6-11(10-12(13)16)21-15(20)17-2/h6-7,10,14H,8-9H2,1-5H3/p+1/t14?,16-/m0/s1
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n/an/a 3.40n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM10622
PNG
((-)-Phenserine | (3aS)-1,3a,8-trimethyl-1H,2H,3H,3...)
Show SMILES CN1CC[C@]2(C)C1N(C)c1ccc(OC(=O)Nc3ccccc3)cc21
Show InChI InChI=1S/C20H23N3O2/c1-20-11-12-22(2)18(20)23(3)17-10-9-15(13-16(17)20)25-19(24)21-14-7-5-4-6-8-14/h4-10,13,18H,11-12H2,1-3H3,(H,21,24)/t18?,20-/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055200
PNG
((S)-5-Isopropylcarbamoyloxy-1,3a,8-trimethyl-1,2,3...)
Show SMILES CC(C)NC(=O)Oc1ccc2N(C)C3[N@H+](C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C17H25N3O2/c1-11(2)18-16(21)22-12-6-7-14-13(10-12)17(3)8-9-19(4)15(17)20(14)5/h6-7,10-11,15H,8-9H2,1-5H3,(H,18,21)/p+1/t15?,17-/m0/s1
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n/an/a 3.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055180
PNG
((5-Methoxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES COc1ccc(C)c(c1)[N+](C)(C)C
Show InChI InChI=1S/C11H18NO/c1-9-6-7-10(13-5)8-11(9)12(2,3)4/h6-8H,1-5H3/q+1
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n/an/a 3.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055202
PNG
((S)-2-tert-Butyl-2-hydroxy-4,4-dimethyl-morpholin-...)
Show SMILES CC(C)(C)[C@@]1(O)C[N+](C)(C)CCO1
Show InChI InChI=1S/C10H22NO2/c1-9(2,3)10(12)8-11(4,5)6-7-13-10/h12H,6-8H2,1-5H3/q+1/t10-/m1/s1
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n/an/a 3.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055193
PNG
(CHEMBL138072 | Trimethyl-(4-methyl-3-propionyloxy-...)
Show SMILES CCC(=O)Oc1cc(ccc1C)[N+](C)(C)C
Show InChI InChI=1S/C13H20NO2/c1-6-13(15)16-12-9-11(14(3,4)5)8-7-10(12)2/h7-9H,6H2,1-5H3/q+1
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n/an/a 3.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055197
PNG
((R)-2-Hydroxy-4,4-dimethyl-2-trifluoromethyl-morph...)
Show SMILES C[N+]1(C)CCO[C@](O)(C1)C(F)(F)F
Show InChI InChI=1S/C7H13F3NO2/c1-11(2)3-4-13-6(12,5-11)7(8,9)10/h12H,3-5H2,1-2H3/q+1/t6-/m1/s1
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n/an/a 3.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055160
PNG
((S)-5-Diethylcarbamoyloxy-1,3a,8-trimethyl-1,2,3,3...)
Show SMILES CCN(CC)C(=O)Oc1ccc2N(C)C3[N@H+](C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C18H27N3O2/c1-6-21(7-2)17(22)23-13-8-9-15-14(12-13)18(3)10-11-19(4)16(18)20(15)5/h8-9,12,16H,6-7,10-11H2,1-5H3/p+1/t16?,18-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055171
PNG
((3-Acetoxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES CC(=O)Oc1cccc(c1C)[N+](C)(C)C
Show InChI InChI=1S/C12H18NO2/c1-9-11(13(3,4)5)7-6-8-12(9)15-10(2)14/h6-8H,1-5H3/q+1
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n/an/a 4.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055164
PNG
((2-Mercapto-ethyl)-trimethyl-ammonium; iodide | CH...)
Show SMILES C[N+](C)(C)CCS
Show InChI InChI=1S/C5H13NS/c1-6(2,3)4-5-7/h4-5H2,1-3H3/p+1
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n/an/a 4.40n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055156
PNG
((S)-5-Benzylcarbamoyloxy-1,3a,8-trimethyl-1,2,3,3a...)
Show SMILES CN1C2[N@H+](C)CC[C@@]2(C)c2cc(OC(=O)NCc3ccccc3)ccc12
Show InChI InChI=1S/C21H25N3O2/c1-21-11-12-23(2)19(21)24(3)18-10-9-16(13-17(18)21)26-20(25)22-14-15-7-5-4-6-8-15/h4-10,13,19H,11-12,14H2,1-3H3,(H,22,25)/p+1/t19?,21-/m0/s1
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n/an/a 4.60n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055203
PNG
((4-Iodo-butyl)-trimethyl-ammonium; iodide | CHEMBL...)
Show SMILES C[N+](C)(C)CCCCI
Show InChI InChI=1S/C7H17IN/c1-9(2,3)7-5-4-6-8/h4-7H2,1-3H3/q+1
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n/an/a 4.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055179
PNG
((S)-2-Hydroxy-4,4-dimethyl-2-(4-nitro-phenyl)-morp...)
Show SMILES C[N+]1(C)CCO[C@](O)(C1)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C12H17N2O4/c1-14(2)7-8-18-12(15,9-14)10-3-5-11(6-4-10)13(16)17/h3-6,15H,7-9H2,1-2H3/q+1/t12-/m1/s1
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n/an/a 5.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055188
PNG
((5-Acetoxy-2-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES CC(=O)Oc1ccc(C)c(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H18NO2/c1-9-6-7-11(15-10(2)14)8-12(9)13(3,4)5/h6-8H,1-5H3/q+1
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n/an/a 5.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055210
PNG
((5-Bromo-pentyl)-trimethyl-ammonium; bromide | CHE...)
Show SMILES C[N+](C)(C)CCCCCBr
Show InChI InChI=1S/C8H19BrN/c1-10(2,3)8-6-4-5-7-9/h4-8H2,1-3H3/q+1
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n/an/a 5.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50004000
PNG
((3aS,8aR)-1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro...)
Show SMILES CNC(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1
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n/an/a 5.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055157
PNG
(CHEMBL136294 | Trimethyl-(3-propionyloxy-phenyl)-a...)
Show SMILES CCC(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H18NO2/c1-5-12(14)15-11-8-6-7-10(9-11)13(2,3)4/h6-9H,5H2,1-4H3/q+1
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n/an/a 6n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055176
PNG
((4-Bromo-butyl)-trimethyl-ammonium; bromide | CHEM...)
Show SMILES C[N+](C)(C)CCCCBr
Show InChI InChI=1S/C7H17BrN/c1-9(2,3)7-5-4-6-8/h4-7H2,1-3H3/q+1
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n/an/a 6n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055187
PNG
((3-Methoxy-phenyl)-trimethyl-ammonium | CHEMBL1361...)
Show SMILES COc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C10H16NO/c1-11(2,3)9-6-5-7-10(8-9)12-4/h5-8H,1-4H3/q+1
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n/an/a 6n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50055178
PNG
(5-(2-Benzyl-acetamino-methylcarbomylo)-1,3a,8-trim...)
Show SMILES CN(C(=O)NCc1ccccc1)C(=O)Oc1ccc2N(C)C3[N@H+](C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C23H28N4O3/c1-23-12-13-25(2)20(23)26(3)19-11-10-17(14-18(19)23)30-22(29)27(4)21(28)24-15-16-8-6-5-7-9-16/h5-11,14,20H,12-13,15H2,1-4H3,(H,24,28)/p+1/t20?,23-/m0/s1
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n/an/a 6.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055190
PNG
(CHEMBL148484 | CHEMBL609718 | Trimethyl-(3-nitro-p...)
Show SMILES C[N+](C)(C)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C9H13N2O2/c1-11(2,3)9-6-4-5-8(7-9)10(12)13/h4-7H,1-3H3/q+1
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n/an/a 6.30n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055192
PNG
((3-Acetoxy-4-methyl-phenyl)-trimethyl-ammonium | C...)
Show SMILES CC(=O)Oc1cc(ccc1C)[N+](C)(C)C
Show InChI InChI=1S/C12H18NO2/c1-9-6-7-11(13(3,4)5)8-12(9)15-10(2)14/h6-8H,1-5H3/q+1
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n/an/a 6.60n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055205
PNG
(CHEMBL136669 | Trimethyl-(2-methyl-5-propionyloxy-...)
Show SMILES CCC(=O)Oc1ccc(C)c(c1)[N+](C)(C)C
Show InChI InChI=1S/C13H20NO2/c1-6-13(15)16-11-8-7-10(2)12(9-11)14(3,4)5/h7-9H,6H2,1-5H3/q+1
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n/an/a 6.90n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055184
PNG
((S)-2-(4-Amino-phenyl)-2-hydroxy-4,4-dimethyl-morp...)
Show SMILES C[N+]1(C)CCO[C@](O)(C1)c1ccc(N)cc1
Show InChI InChI=1S/C12H19N2O2/c1-14(2)7-8-16-12(15,9-14)10-3-5-11(13)6-4-10/h3-6,15H,7-9,13H2,1-2H3/q+1/t12-/m1/s1
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n/an/a 6.90n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055183
PNG
(CHEMBL136670 | Trimethyl-(2-methyl-3-propionyloxy-...)
Show SMILES CCC(=O)Oc1cccc(c1C)[N+](C)(C)C
Show InChI InChI=1S/C13H20NO2/c1-6-13(15)16-12-9-7-8-11(10(12)2)14(3,4)5/h7-9H,6H2,1-5H3/q+1
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n/an/a 7.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM8961
PNG
(1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...)
Show SMILES Nc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)
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PubMed
n/an/a 7.60n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM120262
PNG
(EDROPHONIUM BROMIDE | EDROPHONIUM CHLORIDE | Edrop...)
Show SMILES CC[N+](C)(C)c1cccc(O)c1
Show InChI InChI=1S/C10H15NO/c1-4-11(2,3)9-6-5-7-10(12)8-9/h5-8H,4H2,1-3H3/p+1
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n/an/a 7.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM10624
PNG
(1,5-bis(4-allyldimethylammoniumphenyl)-pentan-3-on...)
Show SMILES C[N+](C)(CC=C)c1ccc(CCC(=O)CCc2ccc(cc2)[N+](C)(C)CC=C)cc1
Show InChI InChI=1S/C27H38N2O/c1-7-21-28(3,4)25-15-9-23(10-16-25)13-19-27(30)20-14-24-11-17-26(18-12-24)29(5,6)22-8-2/h7-12,15-18H,1-2,13-14,19-22H2,3-6H3/q+2
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n/an/a 8n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055167
PNG
((S)-2-(4-Chloro-phenyl)-2-hydroxy-4,4-dimethyl-mor...)
Show SMILES C[N+]1(C)CCO[C@](O)(C1)c1ccc(Cl)cc1
Show InChI InChI=1S/C12H17ClNO2/c1-14(2)7-8-16-12(15,9-14)10-3-5-11(13)6-4-10/h3-6,15H,7-9H2,1-2H3/q+1/t12-/m1/s1
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n/an/a 8.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055166
PNG
(CHEMBL136229 | CHEMBL150054 | Hexyl-trimethyl-ammo...)
Show SMILES CCCCCC[N+](C)(C)C
Show InChI InChI=1S/C9H22N/c1-5-6-7-8-9-10(2,3)4/h5-9H2,1-4H3/q+1
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n/an/a 8.20n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055196
PNG
(But-3-enyl-trimethyl-ammonium; bromide | CHEMBL135...)
Show SMILES C[N+](C)(C)CCC=C
Show InChI InChI=1S/C7H16N/c1-5-6-7-8(2,3)4/h5H,1,6-7H2,2-4H3/q+1
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n/an/a 8.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055159
PNG
(CHEMBL136916 | CHEMBL150001 | Trimethyl-(4-oxo-pen...)
Show SMILES CC(=O)CCC[N+](C)(C)C
Show InChI InChI=1S/C8H18NO/c1-8(10)6-5-7-9(2,3)4/h5-7H2,1-4H3/q+1
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PubMed
n/an/a 8.5n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50055169
PNG
((3-Bromo-propyl)-trimethyl-ammonium; bromide | CHE...)
Show SMILES C[N+](C)(C)CCCBr
Show InChI InChI=1S/C6H15BrN/c1-8(2,3)6-4-5-7/h4-6H2,1-3H3/q+1
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n/an/a 8.80n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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PubMed
n/an/a 9.10n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM10984
PNG
((3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc2N(C)[C@H]3N(C)CC[C@@]3(C)c2c1
Show InChI InChI=1S/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/m1/s1
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n/an/a 9.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50055186
PNG
((3-Hydroxy-phenyl)-trimethyl-ammonium | CHEMBL3777...)
Show SMILES C[N+](C)(C)c1cccc(O)c1
Show InChI InChI=1S/C9H13NO/c1-10(2,3)8-5-4-6-9(11)7-8/h4-7H,1-3H3/p+1
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n/an/a 9.70n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibitory activity against Acetylcholinesterase


J Med Chem 39: 5064-71 (1997)


Article DOI: 10.1021/jm950771r
BindingDB Entry DOI: 10.7270/Q2PZ59GC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%