Compile Data Set for Download or QSAR
Found 43 Enz. Inhib. hit(s) with all data for entry = 50020941
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM8961(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)
Affinity DataIC50: 30nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM8961(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)
Affinity DataIC50: 150nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219240(4-[4-(benzyloxy)piperidino]butyl-N-(4-chlorophenyl...)
Show SMILES Clc1ccc(NC(=O)OCCCCN2CCC(CC2)OCc2ccccc2)cc1
Show InChI InChI=1S/C23H29ClN2O3/c24-20-8-10-21(11-9-20)25-23(27)28-17-5-4-14-26-15-12-22(13-16-26)29-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2,(H,25,27)
Affinity DataIC50: 250nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219232(4-[4-(benzhydryloxy)piperidino]butyl-4-chlorobenzo...)
Show SMILES Clc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32ClNO3/c30-26-15-13-25(14-16-26)29(32)33-22-8-7-19-31-20-17-27(18-21-31)34-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 310nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219230(4-[4-(benzyloxy)piperidino]butyl-4-fluorobenzoate ...)
Show SMILES Fc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28FNO3/c24-21-10-8-20(9-11-21)23(26)27-17-5-4-14-25-15-12-22(13-16-25)28-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 560nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219235(4-[4-(benzyloxy)piperidino]butyl-N-(4-fluorophenyl...)
Show SMILES Fc1ccc(NC(=O)OCCCCN2CCC(CC2)OCc2ccccc2)cc1
Show InChI InChI=1S/C23H29FN2O3/c24-20-8-10-21(11-9-20)25-23(27)28-17-5-4-14-26-15-12-22(13-16-26)29-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2,(H,25,27)
Affinity DataIC50: 780nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219245(4-[4-(benzhydryloxy)piperidino]butyl 4-fluorobenzo...)
Show SMILES Fc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32FNO3/c30-26-15-13-25(14-16-26)29(32)33-22-8-7-19-31-20-17-27(18-21-31)34-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 840nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219238(4-[4-(benzhydryloxy)piperidino]butyl benzoate | CH...)
Show SMILES O=C(OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H33NO3/c31-29(26-16-8-3-9-17-26)32-23-11-10-20-30-21-18-27(19-22-30)33-28(24-12-4-1-5-13-24)25-14-6-2-7-15-25/h1-9,12-17,27-28H,10-11,18-23H2
Affinity DataIC50: 1.31E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219233(4-[4-(benzyloxy)piperidino]butyl-3-chlorobenzoate ...)
Show SMILES Clc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28ClNO3/c24-21-10-6-9-20(17-21)23(26)27-16-5-4-13-25-14-11-22(12-15-25)28-18-19-7-2-1-3-8-19/h1-3,6-10,17,22H,4-5,11-16,18H2
Affinity DataIC50: 1.35E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219231(4-[4-(benzyloxy)piperidino]butyl-3-fluorobenzoate ...)
Show SMILES Fc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28FNO3/c24-21-10-6-9-20(17-21)23(26)27-16-5-4-13-25-14-11-22(12-15-25)28-18-19-7-2-1-3-8-19/h1-3,6-10,17,22H,4-5,11-16,18H2
Affinity DataIC50: 1.58E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219248(4-[4-(benzyloxy)piperidino]butyl benzoate | CHEMBL...)
Show SMILES O=C(OCCCCN1CCC(CC1)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H29NO3/c25-23(21-11-5-2-6-12-21)26-18-8-7-15-24-16-13-22(14-17-24)27-19-20-9-3-1-4-10-20/h1-6,9-12,22H,7-8,13-19H2
Affinity DataIC50: 1.89E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219249(4-[4-(benzhydryloxy)piperidino]butyl-4-(tert-butyl...)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C33H41NO3/c1-33(2,3)29-18-16-28(17-19-29)32(35)36-25-11-10-22-34-23-20-30(21-24-34)37-31(26-12-6-4-7-13-26)27-14-8-5-9-15-27/h4-9,12-19,30-31H,10-11,20-25H2,1-3H3
Affinity DataIC50: 2.41E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219241(4-[4-(benzhydryloxy)piperidino]butyl-N-(4-fluoroph...)
Show SMILES Fc1ccc(NC(=O)OCCCCN2CCC(CC2)OC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C29H33FN2O3/c30-25-13-15-26(16-14-25)31-29(33)34-22-8-7-19-32-20-17-27(18-21-32)35-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2,(H,31,33)
Affinity DataIC50: 2.45E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219242(4-[4-(benzhydryloxy)piperidino]butyl-N-(4-chloroph...)
Show SMILES Clc1ccc(NC(=O)OCCCCN2CCC(CC2)OC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C29H33ClN2O3/c30-25-13-15-26(16-14-25)31-29(33)34-22-8-7-19-32-20-17-27(18-21-32)35-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2,(H,31,33)
Affinity DataIC50: 2.45E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219234(4-[4-(benzhydryloxy)piperidino]butyl 3-chlorobenzo...)
Show SMILES Clc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32ClNO3/c30-26-15-9-14-25(22-26)29(32)33-21-8-7-18-31-19-16-27(17-20-31)34-28(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-15,22,27-28H,7-8,16-21H2
Affinity DataIC50: 3.39E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219244(4-[4-(benzyloxy)piperidino]butyl-4-chlorobenzoate ...)
Show SMILES Clc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28ClNO3/c24-21-10-8-20(9-11-21)23(26)27-17-5-4-14-25-15-12-22(13-16-25)28-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 3.52E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219239(4-[4-(benzhydryloxy)piperidino]butyl 4-isopropylbe...)
Show SMILES CC(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C32H39NO3/c1-25(2)26-15-17-29(18-16-26)32(34)35-24-10-9-21-33-22-19-30(20-23-33)36-31(27-11-5-3-6-12-27)28-13-7-4-8-14-28/h3-8,11-18,25,30-31H,9-10,19-24H2,1-2H3
Affinity DataIC50: 3.89E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219236(4-[4-(benzyloxy)piperidino]butyl-4-nitrobenzoate |...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28N2O5/c26-23(20-8-10-21(11-9-20)25(27)28)29-17-5-4-14-24-15-12-22(13-16-24)30-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 5.23E+3nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219237(4-[4-(benzhydryloxy)piperidino]butyl-4-nitrobenzoa...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32N2O5/c32-29(25-13-15-26(16-14-25)31(33)34)35-22-8-7-19-30-20-17-27(18-21-30)36-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 7.25E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219246(4-[4-(benzhydryloxy)piperidino]butyl 3-fluorobenzo...)
Show SMILES Fc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32FNO3/c30-26-15-9-14-25(22-26)29(32)33-21-8-7-18-31-19-16-27(17-20-31)34-28(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-15,22,27-28H,7-8,16-21H2
Affinity DataIC50: 7.72E+3nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM8960((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...)
Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC
Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3
Affinity DataIC50: 1.01E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219229(4-[4-(benzyloxy)piperidino]butyl-4-isopropylbenzoa...)
Show SMILES CC(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C26H35NO3/c1-21(2)23-10-12-24(13-11-23)26(28)29-19-7-6-16-27-17-14-25(15-18-27)30-20-22-8-4-3-5-9-22/h3-5,8-13,21,25H,6-7,14-20H2,1-2H3
Affinity DataIC50: 1.08E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219247(4-[4-(benzyloxy)piperidino]butyl-4-(tert-butyl)-be...)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C27H37NO3/c1-27(2,3)24-13-11-23(12-14-24)26(29)30-20-8-7-17-28-18-15-25(16-19-28)31-21-22-9-5-4-6-10-22/h4-6,9-14,25H,7-8,15-21H2,1-3H3
Affinity DataIC50: 1.22E+4nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219242(4-[4-(benzhydryloxy)piperidino]butyl-N-(4-chloroph...)
Show SMILES Clc1ccc(NC(=O)OCCCCN2CCC(CC2)OC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C29H33ClN2O3/c30-25-13-15-26(16-14-25)31-29(33)34-22-8-7-19-32-20-17-27(18-21-32)35-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2,(H,31,33)
Affinity DataIC50: 1.37E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219229(4-[4-(benzyloxy)piperidino]butyl-4-isopropylbenzoa...)
Show SMILES CC(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C26H35NO3/c1-21(2)23-10-12-24(13-11-23)26(28)29-19-7-6-16-27-17-14-25(15-18-27)30-20-22-8-4-3-5-9-22/h3-5,8-13,21,25H,6-7,14-20H2,1-2H3
Affinity DataIC50: 1.48E+4nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219247(4-[4-(benzyloxy)piperidino]butyl-4-(tert-butyl)-be...)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C27H37NO3/c1-27(2,3)24-13-11-23(12-14-24)26(29)30-20-8-7-17-28-18-15-25(16-19-28)31-21-22-9-5-4-6-10-22/h4-6,9-14,25H,7-8,15-21H2,1-3H3
Affinity DataIC50: 1.52E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219241(4-[4-(benzhydryloxy)piperidino]butyl-N-(4-fluoroph...)
Show SMILES Fc1ccc(NC(=O)OCCCCN2CCC(CC2)OC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C29H33FN2O3/c30-25-13-15-26(16-14-25)31-29(33)34-22-8-7-19-32-20-17-27(18-21-32)35-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2,(H,31,33)
Affinity DataIC50: 1.57E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219245(4-[4-(benzhydryloxy)piperidino]butyl 4-fluorobenzo...)
Show SMILES Fc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32FNO3/c30-26-15-13-25(14-16-26)29(32)33-22-8-7-19-31-20-17-27(18-21-31)34-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 2.22E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219239(4-[4-(benzhydryloxy)piperidino]butyl 4-isopropylbe...)
Show SMILES CC(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C32H39NO3/c1-25(2)26-15-17-29(18-16-26)32(34)35-24-10-9-21-33-22-19-30(20-23-33)36-31(27-11-5-3-6-12-27)28-13-7-4-8-14-28/h3-8,11-18,25,30-31H,9-10,19-24H2,1-2H3
Affinity DataIC50: 2.32E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219237(4-[4-(benzhydryloxy)piperidino]butyl-4-nitrobenzoa...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32N2O5/c32-29(25-13-15-26(16-14-25)31(33)34)35-22-8-7-19-30-20-17-27(18-21-30)36-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 2.68E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219238(4-[4-(benzhydryloxy)piperidino]butyl benzoate | CH...)
Show SMILES O=C(OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H33NO3/c31-29(26-16-8-3-9-17-26)32-23-11-10-20-30-21-18-27(19-22-30)33-28(24-12-4-1-5-13-24)25-14-6-2-7-15-25/h1-9,12-17,27-28H,10-11,18-23H2
Affinity DataIC50: 3.16E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219246(4-[4-(benzhydryloxy)piperidino]butyl 3-fluorobenzo...)
Show SMILES Fc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32FNO3/c30-26-15-9-14-25(22-26)29(32)33-21-8-7-18-31-19-16-27(17-20-31)34-28(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-15,22,27-28H,7-8,16-21H2
Affinity DataIC50: 3.16E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219232(4-[4-(benzhydryloxy)piperidino]butyl-4-chlorobenzo...)
Show SMILES Clc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32ClNO3/c30-26-15-13-25(14-16-26)29(32)33-22-8-7-19-31-20-17-27(18-21-31)34-28(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-6,9-16,27-28H,7-8,17-22H2
Affinity DataIC50: 3.84E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219234(4-[4-(benzhydryloxy)piperidino]butyl 3-chlorobenzo...)
Show SMILES Clc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C29H32ClNO3/c30-26-15-9-14-25(22-26)29(32)33-21-8-7-18-31-19-16-27(17-20-31)34-28(23-10-3-1-4-11-23)24-12-5-2-6-13-24/h1-6,9-15,22,27-28H,7-8,16-21H2
Affinity DataIC50: 5.79E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetCholinesterase(Homo sapiens (Human))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219249(4-[4-(benzhydryloxy)piperidino]butyl-4-(tert-butyl...)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OC(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C33H41NO3/c1-33(2,3)29-18-16-28(17-19-29)32(35)36-25-11-10-22-34-23-20-30(21-24-34)37-31(26-12-6-4-7-13-26)27-14-8-5-9-15-27/h4-9,12-19,30-31H,10-11,20-25H2,1-3H3
Affinity DataIC50: 7.89E+4nMAssay Description:Inhibition of human BChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219235(4-[4-(benzyloxy)piperidino]butyl-N-(4-fluorophenyl...)
Show SMILES Fc1ccc(NC(=O)OCCCCN2CCC(CC2)OCc2ccccc2)cc1
Show InChI InChI=1S/C23H29FN2O3/c24-20-8-10-21(11-9-20)25-23(27)28-17-5-4-14-26-15-12-22(13-16-26)29-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2,(H,25,27)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219248(4-[4-(benzyloxy)piperidino]butyl benzoate | CHEMBL...)
Show SMILES O=C(OCCCCN1CCC(CC1)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H29NO3/c25-23(21-11-5-2-6-12-21)26-18-8-7-15-24-16-13-22(14-17-24)27-19-20-9-3-1-4-10-20/h1-6,9-12,22H,7-8,13-19H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219236(4-[4-(benzyloxy)piperidino]butyl-4-nitrobenzoate |...)
Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28N2O5/c26-23(20-8-10-21(11-9-20)25(27)28)29-17-5-4-14-24-15-12-22(13-16-24)30-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219233(4-[4-(benzyloxy)piperidino]butyl-3-chlorobenzoate ...)
Show SMILES Clc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28ClNO3/c24-21-10-6-9-20(17-21)23(26)27-16-5-4-13-25-14-11-22(12-15-25)28-18-19-7-2-1-3-8-19/h1-3,6-10,17,22H,4-5,11-16,18H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219230(4-[4-(benzyloxy)piperidino]butyl-4-fluorobenzoate ...)
Show SMILES Fc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28FNO3/c24-21-10-8-20(9-11-21)23(26)27-17-5-4-14-25-15-12-22(13-16-25)28-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219231(4-[4-(benzyloxy)piperidino]butyl-3-fluorobenzoate ...)
Show SMILES Fc1cccc(c1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28FNO3/c24-21-10-6-9-20(17-21)23(26)27-16-5-4-13-25-14-11-22(12-15-25)28-18-19-7-2-1-3-8-19/h1-3,6-10,17,22H,4-5,11-16,18H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219240(4-[4-(benzyloxy)piperidino]butyl-N-(4-chlorophenyl...)
Show SMILES Clc1ccc(NC(=O)OCCCCN2CCC(CC2)OCc2ccccc2)cc1
Show InChI InChI=1S/C23H29ClN2O3/c24-20-8-10-21(11-9-20)25-23(27)28-17-5-4-14-26-15-12-22(13-16-26)29-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2,(H,25,27)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
Woosuk University

Curated by ChEMBL
LigandPNGBDBM50219244(4-[4-(benzyloxy)piperidino]butyl-4-chlorobenzoate ...)
Show SMILES Clc1ccc(cc1)C(=O)OCCCCN1CCC(CC1)OCc1ccccc1
Show InChI InChI=1S/C23H28ClNO3/c24-21-10-8-20(9-11-21)23(26)27-17-5-4-14-25-15-12-22(13-16-25)28-18-19-6-2-1-3-7-19/h1-3,6-11,22H,4-5,12-18H2
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of Electrophorus electricus AChE by Ellman's methodMore data for this Ligand-Target Pair