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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Voltage-gated L-type calcium channel' and Ligand = 'BDBM50000344'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-gated L-type calcium channel


(Homo sapiens (Human))
BDBM50000344
PNG
(Acetic acid 4-(4-methoxymethoxy-phenyl)-1-(2-methy...)
Show SMILES CNCCN1c2cccc(c2C[C@H]([C@@H](OC(C)=O)C1=O)c1ccc(OCOC)cc1)C(F)(F)F
Show InChI InChI=1S/C24H27F3N2O5/c1-15(30)34-22-18(16-7-9-17(10-8-16)33-14-32-3)13-19-20(24(25,26)27)5-4-6-21(19)29(23(22)31)12-11-28-2/h4-10,18,22,28H,11-14H2,1-3H3/t18-,22+/m0/s1
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/a 1.55E+5n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro ability to displace the specific binding of [3H]-diltiazem to diltiazem receptor in guinea pig skeletal muscle.


J Med Chem 35: 780-93 (1992)


Article DOI: 10.1021/jm00082a020
BindingDB Entry DOI: 10.7270/Q2K64H14
More data for this
Ligand-Target Pair