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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50021847   
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


(RAT)
BDBM50021847
PNG
(5-[2-(4-Methyl-piperazin-1-yl)-acetyl]-5,10-dihydr...)
Show SMILES CN1CCN(CC(=O)N2c3ccccc3NC(=O)c3ccccc23)CC1
Show InChI InChI=1S/C20H22N4O2/c1-22-10-12-23(13-11-22)14-19(25)24-17-8-4-2-6-15(17)20(26)21-16-7-3-5-9-18(16)24/h2-9H,10-14H2,1H3,(H,21,26)
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PC cid
PC sid
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PubMed
n/an/a 23n/an/an/an/an/an/a



Dr. Karl Thomae GmbH

Curated by ChEMBL


Assay Description
Binding affinity towards Muscarinic acetylcholine receptor M1 of cerebral cortex


J Med Chem 31: 1169-74 (1988)


BindingDB Entry DOI: 10.7270/Q2DV1HW6
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50021847
PNG
(5-[2-(4-Methyl-piperazin-1-yl)-acetyl]-5,10-dihydr...)
Show SMILES CN1CCN(CC(=O)N2c3ccccc3NC(=O)c3ccccc23)CC1
Show InChI InChI=1S/C20H22N4O2/c1-22-10-12-23(13-11-22)14-19(25)24-17-8-4-2-6-15(17)20(26)21-16-7-3-5-9-18(16)24/h2-9H,10-14H2,1H3,(H,21,26)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 100n/an/an/an/an/an/a



Dr. Karl Thomae GmbH

Curated by ChEMBL


Assay Description
Binding affinity towards muscarinic receptor of gastric fundus containing Muscarinic acetylcholine receptor M2


J Med Chem 31: 1169-74 (1988)


BindingDB Entry DOI: 10.7270/Q2DV1HW6
More data for this
Ligand-Target Pair