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BDBM50009229 1-(3-Carboxy-propyl)-3-ethyl-2-[3-(1,3,3-trimethyl-1,3-dihydro-indol-2-ylidene)-propenyl]-3H-imidazo[4,5-b]quinoxalin-1-ium; chloride::CHEMBL301946

SMILES: CCn1c(\C=C\C=C2\N(C)c3ccccc3C2(C)C)[n+](CCCC(O)=O)c2nc3ccccc3nc12

InChI Key: InChIKey=IONYRXHXPXXTKR-UHFFFAOYSA-O

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009229   
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))
BDBM50009229
PNG
(1-(3-Carboxy-propyl)-3-ethyl-2-[3-(1,3,3-trimethyl...)
Show SMILES CCn1c(\C=C\C=C2\N(C)c3ccccc3C2(C)C)[n+](CCCC(O)=O)c2nc3ccccc3nc12
Show InChI InChI=1S/C29H31N5O2/c1-5-33-25(17-10-16-24-29(2,3)20-12-6-9-15-23(20)32(24)4)34(19-11-18-26(35)36)28-27(33)30-21-13-7-8-14-22(21)31-28/h6-10,12-17H,5,11,18-19H2,1-4H3/p+1
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PC sid
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Similars

Article
PubMed
n/an/a 1.40E+3n/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