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Compile Data Set for Download or QSAR

Found 64 hits Enz. Inhib. hit(s) with all data for entry = 50048385   
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
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213281
PNG
(CHEMBL351561)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7-,17-16+
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n/an/a 0.0200n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213074
PNG
(CHEMBL156050)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18+
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n/an/a 0.0300n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213283
PNG
(CHEMBL350223)
Show SMILES COc1ccc(cc1)C#C\C(C)=C/CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(3-4-16-5-7-18(22-2)8-6-16)10-12-23-20-19-14-21-11-9-17(19)13-21/h5-8,10,17H,9,11-14H2,1-2H3/b15-10-,20-19+
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n/an/a 0.100n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213207
PNG
(CHEMBL160582)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccccc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H20N2O/c1-15(7-8-16-5-3-2-4-6-16)10-12-21-19-18-14-20-11-9-17(18)13-20/h2-6,10,17H,9,11-14H2,1H3/b15-10-,19-18+
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n/an/a 0.150n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213070
PNG
(CHEMBL405426)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-
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n/an/a 0.450n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213278
PNG
(CHEMBL156445)
Show SMILES COc1cccc(c1)C#C\C(C)=C/CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9-,20-19+
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n/an/a 0.520n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213077
PNG
(CHEMBL348412)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10-,20-19+
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n/an/a 0.570n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213286
PNG
(CHEMBL346580)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(Cl)c(Cl)c1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H18Cl2N2O/c1-13(2-3-14-4-5-16(19)17(20)10-14)7-9-23-21-18-12-22-8-6-15(18)11-22/h4-5,7,10,15H,6,8-9,11-12H2,1H3/b13-7+,21-18+
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n/an/a 0.800n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50065207
PNG
(1-Aza-bicyclo[2.2.1]heptan-3-one O-((Z)-3-methyl-p...)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#C
Show InChI InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5-,13-12+
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213279
PNG
(CHEMBL345415)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccccc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H20N2O/c1-15(7-8-16-5-3-2-4-6-16)10-12-21-19-18-14-20-11-9-17(18)13-20/h2-6,10,17H,9,11-14H2,1H3/b15-10-,19-18-
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n/an/a 1.10n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213079
PNG
(CHEMBL160928)
Show SMILES COc1ccc(cc1OC)C#C\C(C)=C/CO\N=C1/CN2CCC1C2 |THB:17:18:24:22.21|
Show InChI InChI=1S/C20H24N2O3/c1-15(4-5-16-6-7-19(23-2)20(12-16)24-3)9-11-25-21-18-14-22-10-8-17(18)13-22/h6-7,9,12,17H,8,10-11,13-14H2,1-3H3/b15-9-,21-18+
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n/an/a 1.40n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213071
PNG
(CHEMBL160939)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-
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n/an/a 1.60n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50065221
PNG
(1-Aza-bicyclo[2.2.1]heptan-3-one O-((E)-3-methyl-p...)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#C
Show InChI InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5+,13-12+
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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213280
PNG
(CHEMBL348079)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7-,17-16-
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n/an/a 4.10n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213204
PNG
(CHEMBL434469)
Show SMILES COc1cccc(c1)C#C\C(C)=C\CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9+,20-19+
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n/an/a 4.5n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213081
PNG
(CHEMBL159208)
Show SMILES COc1ccc(cc1OC)C#C\C(C)=C/CO\N=C1\CN2CCC1C2 |THB:17:18:24:22.21|
Show InChI InChI=1S/C20H24N2O3/c1-15(4-5-16-6-7-19(23-2)20(12-16)24-3)9-11-25-21-18-14-22-10-8-17(18)13-22/h6-7,9,12,17H,8,10-11,13-14H2,1-3H3/b15-9-,21-18-
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n/an/a 4.60n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213080
PNG
(CHEMBL160858)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7+,17-16+
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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213075
PNG
(CHEMBL345205)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10-,20-19-
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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213073
PNG
(CHEMBL156749)
Show SMILES COc1ccc(cc1OC)C#C\C(C)=C\CO\N=C1/CN2CCC1C2 |THB:17:18:24:22.21|
Show InChI InChI=1S/C20H24N2O3/c1-15(4-5-16-6-7-19(23-2)20(12-16)24-3)9-11-25-21-18-14-22-10-8-17(18)13-22/h6-7,9,12,17H,8,10-11,13-14H2,1-3H3/b15-9+,21-18+
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n/an/a 5.40n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213078
PNG
(CHEMBL345250)
Show SMILES C\C(=C/CO\N=C1\CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9+,20-18-
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n/an/a 6.5n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50004656
PNG
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)
Show SMILES C[N+](C)(C)CCOC(N)=O
Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
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n/an/a 6.70n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213205
PNG
(CHEMBL158180)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9+,20-18+
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n/an/a 9.80n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213285
PNG
(CHEMBL157198)
Show SMILES COc1ccc(cc1)C#C\C(C)=C\CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(3-4-16-5-7-18(22-2)8-6-16)10-12-23-20-19-14-21-11-9-17(19)13-21/h5-8,10,17H,9,11-14H2,1-2H3/b15-10+,20-19+
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50065226
PNG
(1-Aza-bicyclo[2.2.1]heptan-3-one O-((E)-3-methyl-5...)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccccc1
Show InChI InChI=1S/C18H20N2O/c1-15(7-8-16-5-3-2-4-6-16)10-12-21-19-18-14-20-11-9-17(18)13-20/h2-6,10,17H,9,11-14H2,1H3/b15-10+,19-18+
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213209
PNG
(CHEMBL434072)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#C |THB:5:6:12:10.9|
Show InChI InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5-,13-12-
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213076
PNG
(CHEMBL156925)
Show SMILES COc1cccc(c1)C#C\C(C)=C\CO\N=C1\CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9+,20-19-
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n/an/a 13n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213072
PNG
(CHEMBL160554)
Show SMILES COc1cccc(c1)C#C\C(C)=C/CO\N=C1\CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9-,20-19-
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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213074
PNG
(CHEMBL156050)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18+
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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213206
PNG
(CHEMBL157197)
Show SMILES COc1ccc(cc1)C#C\C(C)=C/CO\N=C1\CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(3-4-16-5-7-18(22-2)8-6-16)10-12-23-20-19-14-21-11-9-17(19)13-21/h5-8,10,17H,9,11-14H2,1-2H3/b15-10-,20-19-
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n/an/a 17n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213281
PNG
(CHEMBL351561)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7-,17-16+
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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213284
PNG
(CHEMBL160509)
Show SMILES C\C(=C/CO\N=C1\CN2CCC1C2)C#C |THB:5:6:12:10.9|
Show InChI InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5+,13-12-
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n/an/a 21n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213282
PNG
(CHEMBL346123)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10+,20-19+
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n/an/a 22n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213277
PNG
(CHEMBL160541)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9+,20-18+
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n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213207
PNG
(CHEMBL160582)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccccc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H20N2O/c1-15(7-8-16-5-3-2-4-6-16)10-12-21-19-18-14-20-11-9-17(18)13-20/h2-6,10,17H,9,11-14H2,1H3/b15-10-,19-18+
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n/an/a 44n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213283
PNG
(CHEMBL350223)
Show SMILES COc1ccc(cc1)C#C\C(C)=C/CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(3-4-16-5-7-18(22-2)8-6-16)10-12-23-20-19-14-21-11-9-17(19)13-21/h5-8,10,17H,9,11-14H2,1-2H3/b15-10-,20-19+
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n/an/a 60n/an/an/an/an/an/a


TBA

Assay Description
60 Binding affinity against muscarinic receptor was evaluated using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparati...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213077
PNG
(CHEMBL348412)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10-,20-19+
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n/an/a 64n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213276
PNG
(CHEMBL160288)
Show SMILES C\C(=C/CO\N=C1\CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7+,17-16-
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n/an/a 80n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldioxolane (CMD) binding assay in membrane preparations of rat neocortex.


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213070
PNG
(CHEMBL405426)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-
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n/an/a 81n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213278
PNG
(CHEMBL156445)
Show SMILES COc1cccc(c1)C#C\C(C)=C/CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9-,20-19+
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n/an/a 88n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213286
PNG
(CHEMBL346580)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(Cl)c(Cl)c1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H18Cl2N2O/c1-13(2-3-14-4-5-16(19)17(20)10-14)7-9-23-21-18-12-22-8-6-15(18)11-22/h4-5,7,10,15H,6,8-9,11-12H2,1H3/b13-7+,21-18+
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n/an/a 171n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213279
PNG
(CHEMBL345415)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccccc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H20N2O/c1-15(7-8-16-5-3-2-4-6-16)10-12-21-19-18-14-20-11-9-17(18)13-20/h2-6,10,17H,9,11-14H2,1H3/b15-10-,19-18-
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n/an/a 181n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213071
PNG
(CHEMBL160939)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9-,20-18-
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n/an/a 219n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213075
PNG
(CHEMBL345205)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10-,20-19-
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n/an/a 383n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213204
PNG
(CHEMBL434469)
Show SMILES COc1cccc(c1)C#C\C(C)=C\CO\N=C1/CN2CCC1C2 |THB:15:16:22:20.19|
Show InChI InChI=1S/C19H22N2O2/c1-15(6-7-16-4-3-5-18(12-16)22-2)9-11-23-20-19-14-21-10-8-17(19)13-21/h3-5,9,12,17H,8,10-11,13-14H2,1-2H3/b15-9+,20-19+
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n/an/a 384n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213277
PNG
(CHEMBL160541)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(Cl)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19ClN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9+,20-18+
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n/an/a 439n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213280
PNG
(CHEMBL348079)
Show SMILES C\C(=C\CO\N=C1\CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7-,17-16-
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n/an/a 608n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213282
PNG
(CHEMBL346123)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(C)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C19H22N2O/c1-15-3-6-17(7-4-15)8-5-16(2)10-12-22-20-19-14-21-11-9-18(19)13-21/h3-4,6-7,10,18H,9,11-14H2,1-2H3/b16-10+,20-19+
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n/an/a 681n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50065207
PNG
(1-Aza-bicyclo[2.2.1]heptan-3-one O-((Z)-3-methyl-p...)
Show SMILES C\C(=C\CO\N=C1/CN2CCC1C2)C#C
Show InChI InChI=1S/C12H16N2O/c1-3-10(2)5-7-15-13-12-9-14-6-4-11(12)8-14/h1,5,11H,4,6-9H2,2H3/b10-5-,13-12+
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n/an/a 807n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213080
PNG
(CHEMBL160858)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1cccs1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C16H18N2OS/c1-13(4-5-15-3-2-10-20-15)7-9-19-17-16-12-18-8-6-14(16)11-18/h2-3,7,10,14H,6,8-9,11-12H2,1H3/b13-7+,17-16+
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n/an/a 968n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50213205
PNG
(CHEMBL158180)
Show SMILES C\C(=C/CO\N=C1/CN2CCC1C2)C#Cc1ccc(F)cc1 |THB:5:6:12:10.9|
Show InChI InChI=1S/C18H19FN2O/c1-14(2-3-15-4-6-17(19)7-5-15)9-11-22-20-18-13-21-10-8-16(18)12-21/h4-7,9,16H,8,10-13H2,1H3/b14-9+,20-18+
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n/an/a 1.07E+3n/an/an/an/an/an/a


TBA

Assay Description
Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl benzilate (QNB) binding assay in membrane preparations of rat neocor...


Citation and Details

BindingDB Entry DOI: 10.7270/Q23B628P
More data for this
Ligand-Target Pair
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