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Compile Data Set for Download or QSAR

Found 3 hits of kd for Acetylcholine receptor
having polymerids = 50002849,50002857 and
complexids = 50000173   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholine receptor protein alpha/beta/delta/gamma chain


(Torpedo californica)
BDBM50038413
PNG
(CHEMBL136284 | N,N'-(2,3-dihydroxylbenzyl)-N,N,N',...)
Show SMILES C[N+](C)(CCCCCC[N+](C)(C)Cc1cccc(O)c1O)Cc1cccc(O)c1O
Show InChI InChI=1S/C24H36N2O4/c1-25(2,17-19-11-9-13-21(27)23(19)29)15-7-5-6-8-16-26(3,4)18-20-12-10-14-22(28)24(20)30/h9-14H,5-8,15-18H2,1-4H3,(H2-2,27,28,29,30)/p+2
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PC sid
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PubMed
n/an/an/a 18n/an/an/an/an/a



University of Toledo

Curated by ChEMBL


Assay Description
Compound was evaluated for the binding constant for association with nicotinic acetylcholine receptor (nAChR)


J Med Chem 37: 4417-20 (1995)

Checked by Author
More data for this
Ligand-Target Pair
Acetylcholine receptor protein alpha/beta/delta/gamma chain


(Torpedo californica)
BDBM50038416
PNG
((1,6-trimethyl ammonium)hexane; dibromide | CHEMBL...)
Show SMILES C[N+](C)(C)CCCCCC[N+](C)(C)C
Show InChI InChI=1S/C12H30N2/c1-13(2,3)11-9-7-8-10-12-14(4,5)6/h7-12H2,1-6H3/q+2
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PubMed
n/an/an/a 1.80E+3n/an/an/an/an/a



University of Toledo

Curated by ChEMBL


Assay Description
Compound was evaluated for the binding constant for association with nicotinic acetylcholine receptor (nAChR)


J Med Chem 37: 4417-20 (1995)

Checked by Author
More data for this
Ligand-Target Pair
Acetylcholine receptor protein alpha/beta/delta/gamma chain


(Torpedo californica)
BDBM50038414
PNG
(CHEMBL138569 | N,N'-(2,3-dihydroxylbenzyl)-N,N,N',...)
Show SMILES C[N+](C)(CCCCCCCCCC[N+](C)(C)Cc1cccc(O)c1O)Cc1cccc(O)c1O
Show InChI InChI=1S/C28H44N2O4/c1-29(2,21-23-15-13-17-25(31)27(23)33)19-11-9-7-5-6-8-10-12-20-30(3,4)22-24-16-14-18-26(32)28(24)34/h13-18H,5-12,19-22H2,1-4H3,(H2-2,31,32,33,34)/p+2
PDB

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PC cid
PC sid
UniChem

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PubMed
n/an/an/a 230n/an/an/an/an/a



University of Toledo

Curated by ChEMBL


Assay Description
Compound was evaluated for the binding constant for association with nicotinic acetylcholine receptor (nAChR)


J Med Chem 37: 4417-20 (1995)

Checked by Author
More data for this
Ligand-Target Pair