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BDBM50355626 CHEMBL1910860

SMILES: CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](C1)Oc1cc(O)cc(F)c1

InChI Key: InChIKey=HQOWLVGGFHIDSX-RUZDIDTESA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50355626   
Target/Host
(Institution)
LigandTarget/Host
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
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50355626
PNG
(CHEMBL1910860)
Show SMILES CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC[C@H](C1)Oc1cc(O)cc(F)c1 |r|
Show InChI InChI=1S/C29H33FN2O3/c1-28(2,32-16-13-25(20-32)35-26-18-23(30)17-24(33)19-26)14-15-29(27(31)34,21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-12,17-19,25,33H,13-16,20H2,1-2H3,(H2,31,34)/t25-/m1/s1
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Patents

Article
PubMed
0.560n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant M3 receptor expressed in CHO-K1 cells assessed as inhibition of carbamoyl choline-induced calcium currents a...


J Med Chem 54: 6888-904 (2011)


Article DOI: 10.1021/jm200884j
BindingDB Entry DOI: 10.7270/Q2CZ37JW
More data for this
Ligand-Target Pair