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BDBM50009238 1,3-Diethyl-2-(4-pyrrolidin-1-yl-buta-1,3-dienyl)-3H-imidazo[4,5-b]quinoxalin-1-ium; iodide::CHEMBL296134

SMILES: CCn1c(\C=C\C=C\N2CCCC2)[n+](CC)c2nc3ccccc3nc12

InChI Key: InChIKey=XIUFTFBBLRKDDJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009238   
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
Neurokinin 1 receptor


(Rattus norvegicus (rat))
BDBM50009238
PNG
(1,3-Diethyl-2-(4-pyrrolidin-1-yl-buta-1,3-dienyl)-...)
Show SMILES CCn1c(\C=C\C=C\N2CCCC2)[n+](CC)c2nc3ccccc3nc12
Show InChI InChI=1S/C21H26N5/c1-3-25-19(13-7-8-14-24-15-9-10-16-24)26(4-2)21-20(25)22-17-11-5-6-12-18(17)23-21/h5-8,11-14H,3-4,9-10,15-16H2,1-2H3/q+1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Rochester

Curated by ChEMBL


Assay Description
Binding affinity for tachykinin receptor 1 from rat forebrain tissue, [125I]-BH-SP as radioligand


J Med Chem 34: 1751-3 (1991)


Article DOI: 10.1021/jm00109a034
BindingDB Entry DOI: 10.7270/Q2JQ11MP
More data for this
Ligand-Target Pair