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BDBM50000355 1-(2-Dimethylamino-ethyl)-4-(4-hydroxy-phenyl)-3-methyl-6-trifluoromethyl-1,3,4,5-tetrahydro-benzo[b]azepin-2-one::CHEMBL167512

SMILES: C[C@@H]1[C@@H](Cc2c(cccc2C(F)(F)F)N(CCN(C)C)C1=O)c1ccc(O)cc1

InChI Key: InChIKey=MHYMDSDLEMBUDI-RHSMWYFYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50000355   
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))
BDBM50000355
PNG
(1-(2-Dimethylamino-ethyl)-4-(4-hydroxy-phenyl)-3-m...)
Show SMILES C[C@@H]1[C@@H](Cc2c(cccc2C(F)(F)F)N(CCN(C)C)C1=O)c1ccc(O)cc1
Show InChI InChI=1S/C22H25F3N2O2/c1-14-17(15-7-9-16(28)10-8-15)13-18-19(22(23,24)25)5-4-6-20(18)27(21(14)29)12-11-26(2)3/h4-10,14,17,28H,11-13H2,1-3H3/t14-,17-/m1/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/an/a 1.60E+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