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BDBM50000358 Acetic acid 7-chloro-1-(2-dimethylamino-ethyl)-4-(3-methoxy-phenyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl ester::CHEMBL354353

SMILES: COc1cccc(c1)[C@@H]1Cc2cc(Cl)ccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O

InChI Key: InChIKey=NBEZWPLKNBMAIM-RBBKRZOGSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50000358   
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 L-type calcium channel


(Homo sapiens (Human))
BDBM50000358
PNG
(Acetic acid 7-chloro-1-(2-dimethylamino-ethyl)-4-(...)
Show SMILES COc1cccc(c1)[C@@H]1Cc2cc(Cl)ccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O
Show InChI InChI=1S/C23H27ClN2O4/c1-15(27)30-22-20(16-6-5-7-19(13-16)29-4)14-17-12-18(24)8-9-21(17)26(23(22)28)11-10-25(2)3/h5-9,12-13,20,22H,10-11,14H2,1-4H3/t20-,22+/m0/s1
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Similars

Article
PubMed
n/an/an/a 3.50E+3n/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