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SMILES: CCOC(=O)N1C(\C(=C(/O)OC)C(C)=NC1=S)c1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=OKGUKEIPHKTCKR-WYMLVPIESA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50228792   
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
Voltage-dependent L-type calcium channel subunit alpha-1C/alpha-1D/alpha-1F/alpha-1S


(Homo sapiens (Human))		BDBM50228792
PNG
(CHEMBL88191)
Show SMILES CCOC(=O)N1C(\C(=C(/O)OC)C(C)=NC1=S)c1cccc(c1)[N+]([O-])=O |c:13|
Show InChI InChI=1S/C16H17N3O6S/c1-4-25-16(21)18-13(10-6-5-7-11(8-10)19(22)23)12(14(20)24-3)9(2)17-15(18)26/h5-8,13,20H,4H2,1-3H3/b14-12+
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PubMed
n/an/a 100n/an/an/an/an/an/a



Squibb Institute for Medical Research

Curated by ChEMBL


Assay Description
In vitro vasorelaxant activity (voltage-gated calcium channel blocking activity) was determined with potassium-depolarized rabbit thoracic aorta

J Med Chem 33: 2629-35 (1990)


BindingDB Entry DOI: 10.7270/Q2XD13XV
More data for this
Ligand-Target Pair