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SMILES: CC[C@H](C)[C@H](NC(=O)N1CCC2(CN(C(C)C)C2c2ccc(F)cc2)CC1)C(=O)OC

InChI Key: InChIKey=BVNMUWNXRBKUDC-LTGDSAQFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50322956   
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 T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))		BDBM50322956
PNG
((2R,3R)-methyl 2-(1-(4-fluorophenyl)-2-isopropyl-2...)
Show SMILES CC[C@H](C)[C@H](NC(=O)N1CCC2(CN(C(C)C)C2c2ccc(F)cc2)CC1)C(=O)OC |r|
Show InChI InChI=1S/C24H36FN3O3/c1-6-17(4)20(22(29)31-5)26-23(30)27-13-11-24(12-14-27)15-28(16(2)3)21(24)18-7-9-19(25)10-8-18/h7-10,16-17,20-21H,6,11-15H2,1-5H3,(H,26,30)/t17-,20-,21?/m0/s1
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n/an/a 256n/an/an/an/an/an/a



Merck Research Laboratory

Curated by ChEMBL


Assay Description
Inhibition of human CaV3.2 expressed in HEK293 cells at -100 mV membrane potential by Ionworks HT assay

Bioorg Med Chem Lett 20: 4602-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.012
BindingDB Entry DOI: 10.7270/Q2NS0V34
More data for this
Ligand-Target Pair