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BDBM50067630 2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-(3-{[2-(3,4-dimethoxy-phenoxy)-ethyl]-methyl-amino}-propyl)-thiazolidin-4-one::CHEMBL423535

SMILES: COc1ccc(OCCN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1OC

InChI Key: InChIKey=NVDGAAUKTHPFSV-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50067630   
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
Calcium channel


(RAT)		BDBM50067630
PNG
(2-(3,5-Di-tert-butyl-4-hydroxy-phenyl)-3-(3-{[2-(3...)
Show SMILES COc1ccc(OCCN(C)CCCN2C(SCC2=O)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)cc1OC
Show InChI InChI=1S/C31H46N2O5S/c1-30(2,3)23-17-21(18-24(28(23)35)31(4,5)6)29-33(27(34)20-39-29)14-10-13-32(7)15-16-38-22-11-12-25(36-8)26(19-22)37-9/h11-12,17-19,29,35H,10,13-16,20H2,1-9H3
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PC sid
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Similars
Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Chugai Pharmaceutical Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of K+ induced contractions of the isolated rat aorta.

J Med Chem 41: 4309-16 (1998)


Article DOI: 10.1021/jm980335f
BindingDB Entry DOI: 10.7270/Q23N22JV
More data for this
Ligand-Target Pair