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BDBM50481862 CHEMBL1087275

SMILES: COc1ccc(\C=C\C(=O)N2CCN(CC2)C(=O)CCCCC(c2ccccc2)c2ccccc2)cc1

InChI Key: InChIKey=IZKYUKHROWESFM-DYTRJAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50481862   
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 beta-1/N-type calcium channel subunit alpha-1B/calcium channel subunit alpha-2/delta-1


(Rattus norvegicus-Rattus norvegicus (Rat))		BDBM50481862
PNG
(CHEMBL1087275)
Show SMILES COc1ccc(\C=C\C(=O)N2CCN(CC2)C(=O)CCCCC(c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C32H36N2O3/c1-37-29-19-16-26(17-20-29)18-21-32(36)34-24-22-33(23-25-34)31(35)15-9-8-14-30(27-10-4-2-5-11-27)28-12-6-3-7-13-28/h2-7,10-13,16-21,30H,8-9,14-15,22-25H2,1H3/b21-18+
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



University of Calgary

Curated by ChEMBL


Assay Description
Blocking of rat N-type calcium channel alpha-1B/alpha-2-delta-1/beta-1b activity expressed in HEK293 cells assessed as whole cell current by whole ce...

Bioorg Med Chem Lett 19: 6467-72 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.008
BindingDB Entry DOI: 10.7270/Q2PV6P57
More data for this
Ligand-Target Pair