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BDBM50009226 1,3-Diethyl-2-[3-(1-ethyl-3,3-dimethyl-1,3-dihydro-indol-2-ylidene)-propenyl]-3H-imidazo[4,5-b]quinoxalin-1-ium; chloride::CHEMBL48734

SMILES: CCN1\C(=C\C=C\c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc12

InChI Key: InChIKey=QBYCEIPTXZPIAA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009226   
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))
BDBM50009226
PNG
(1,3-Diethyl-2-[3-(1-ethyl-3,3-dimethyl-1,3-dihydro...)
Show SMILES CCN1\C(=C\C=C\c2n(CC)c3nc4ccccc4nc3[n+]2CC)C(C)(C)c2ccccc12
Show InChI InChI=1S/C28H32N5/c1-6-31-23-17-12-9-14-20(23)28(4,5)24(31)18-13-19-25-32(7-2)26-27(33(25)8-3)30-22-16-11-10-15-21(22)29-26/h9-19H,6-8H2,1-5H3/q+1
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MMDB

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Similars

Article
PubMed
n/an/a 390n/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