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BDBM50067621 3-[3-(Benzyl-methyl-amino)-propyl]-2-(3,5-di-tert-butyl-4-hydroxy-phenyl)-thiazolidin-4-one::CHEMBL137436

SMILES: CN(CCCN1C(SCC1=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C)Cc1ccccc1

InChI Key: InChIKey=XKMYQBUHKIAVCW-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50067621   
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)		BDBM50067621
PNG
(3-[3-(Benzyl-methyl-amino)-propyl]-2-(3,5-di-tert-...)
Show SMILES CN(CCCN1C(SCC1=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C)Cc1ccccc1
Show InChI InChI=1S/C28H40N2O2S/c1-27(2,3)22-16-21(17-23(25(22)32)28(4,5)6)26-30(24(31)19-33-26)15-11-14-29(7)18-20-12-9-8-10-13-20/h8-10,12-13,16-17,26,32H,11,14-15,18-19H2,1-7H3
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PC sid
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Article
PubMed
n/an/a 600n/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