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BDBM50194661 (R)-N-(3-aminocyclohexyl)-1-((S)-1-(3,3,3-triphenylpropanoyl)pyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide trifluoroacetic acid::CHEMBL212530

SMILES: NC1CCCC(C1)NC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CC(c1ccccc1)(c1ccccc1)c1ccccc1

InChI Key: InChIKey=BITHDJZIFIJUBZ-FHRNJKPBSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194661   
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))
BDBM50194661
PNG
((R)-N-(3-aminocyclohexyl)-1-((S)-1-(3,3,3-tripheny...)
Show SMILES NC1CCCC(C1)NC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CC(c1ccccc1)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C37H44N4O3/c38-30-19-10-20-31(25-30)39-35(43)32-21-11-24-41(32)36(44)33-22-12-23-40(33)34(42)26-37(27-13-4-1-5-14-27,28-15-6-2-7-16-28)29-17-8-3-9-18-29/h1-9,13-18,30-33H,10-12,19-26,38H2,(H,39,43)/t30?,31?,32-,33+/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
170n/an/an/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]NMS binding to human cloned M3 receptor expressed in CHO cells


J Med Chem 49: 5653-63 (2006)


Article DOI: 10.1021/jm051205r
BindingDB Entry DOI: 10.7270/Q2F76C6K
More data for this
Ligand-Target Pair