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BDBM50400587 CHEMBL2206257

SMILES: CC[C@H](CO)Nc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C(C)C)c2n1

InChI Key: InChIKey=HRUSKTBHNPVSTC-JOCHJYFZSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50400587   
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-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))		BDBM50400587
PNG
(CHEMBL2206257)
Show SMILES CC[C@H](CO)Nc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Show InChI InChI=1S/C26H32N6O/c1-4-22(17-33)28-26-29-24(23-25(30-26)32(18-27-23)19(2)3)31(15-20-11-7-5-8-12-20)16-21-13-9-6-10-14-21/h5-14,18-19,22,33H,4,15-17H2,1-3H3,(H,28,29,30)/t22-/m1/s1
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Similars
Article
PubMed
n/an/an/an/a>1.00E+6n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at N-type Cav2.2 channel expressed in tsA201 cell assessed as calcium current by whole-cell patch clamp method

ACS Med Chem Lett 3: 985-990 (2012)


Article DOI: 10.1021/ml3002083
BindingDB Entry DOI: 10.7270/Q2BC40P0
More data for this
Ligand-Target Pair