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BDBM50007383 2-(3,4-Dichloro-phenyl)-N-methyl-N-(3-methyl-1-pyrrolidin-1-ylmethyl-butyl)-acetamide::CHEMBL321061

SMILES: CC(C)C[C@@H](CN1CCCC1)N(C)C(=O)Cc1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=SGHSVADHKSBPNW-INIZCTEOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50007383   
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
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50007383
PNG
(2-(3,4-Dichloro-phenyl)-N-methyl-N-(3-methyl-1-pyr...)
Show SMILES CC(C)C[C@@H](CN1CCCC1)N(C)C(=O)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H28Cl2N2O/c1-14(2)10-16(13-23-8-4-5-9-23)22(3)19(24)12-15-6-7-17(20)18(21)11-15/h6-7,11,14,16H,4-5,8-10,12-13H2,1-3H3/t16-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 14n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity against opioid receptor kappa, in guinea pig brain membrane, using [3H]bremazocine as the radioligand.


J Med Chem 34: 3149-58 (1991)


BindingDB Entry DOI: 10.7270/Q2028S53
More data for this
Ligand-Target Pair