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SMILES: CCN1\C(Sc2ccccc12)=C/C=C1CC(C)[n+]2c1n(CC)c1cc3ccccc3cc21

InChI Key: InChIKey=VMQXKYBYXABWMH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50002461   
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
Substance-P receptor


(Rattus norvegicus (rat))		BDBM50002461
PNG
(10-Ethyl-1-[2-(3-ethyl-3H-benzothiazol-2-ylidene)-...)
Show SMILES CCN1\C(Sc2ccccc12)=C/C=C1CC(C)[n+]2c1n(CC)c1cc3ccccc3cc21
Show InChI InChI=1S/C28H28N3S/c1-4-29-23-12-8-9-13-26(23)32-27(29)15-14-22-16-19(3)31-25-18-21-11-7-6-10-20(21)17-24(25)30(5-2)28(22)31/h6-15,17-19H,4-5,16H2,1-3H3/q+1
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Similars
PubMed
n/an/a 180n/an/an/an/an/an/a



Rochester

Curated by ChEMBL


Assay Description
Inhibition of Tachykinin receptor 1 of rat forebrain tissue

J Med Chem 35: 1273-9 (1992)


BindingDB Entry DOI: 10.7270/Q2222SQM
More data for this
Ligand-Target Pair