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BDBM50101970 CHEMBL463726

SMILES: COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)CCc2ccc(OC)c(OC)c2)C(=O)[C@@H]1OC(C)=O

InChI Key: InChIKey=BTSZXDXHHITHKY-SPFVONBBNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50101970   
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


(Cavia porcellus)
BDBM50101970
PNG
(CHEMBL463726)
Show SMILES COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)CCc2ccc(OC)c(OC)c2)C(=O)[C@@H]1OC(C)=O |r|
Show InChI InChI=1/C31H36N2O6S/c1-21(34)39-29-30(23-11-13-24(36-3)14-12-23)40-28-9-7-6-8-25(28)33(31(29)35)19-18-32(2)17-16-22-10-15-26(37-4)27(20-22)38-5/h6-15,20,29-30H,16-19H2,1-5H3/t29-,30+/s2
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 26n/an/an/an/an/an/a



Jagiellonian University

Curated by ChEMBL


Assay Description
Inhibition of L-type calcium channel measured using whole-cell patch clamp in guinea pig ventricular myocytes


J Appl Toxicol 32: 858-66 (2012)


Article DOI: 10.1002/jat.2784
BindingDB Entry DOI: 10.7270/Q2D79D5C
More data for this
Ligand-Target Pair