BindingDB logo
myBDB logout

BDBM50091219 4-[[2,5-Dimethyl-4-(2-methyl-allyl)-piperazin-1-yl]-(3-methoxy-phenyl)-methyl]-N,N-diethyl-benzamide::CHEMBL108993

SMILES: CCN(CC)C(=O)c1ccc(cc1)C(N1C[C@@H](C)N(CC(C)=C)C[C@@H]1C)c1cccc(OC)c1

InChI Key: InChIKey=RBFSGWDVCZCZKJ-UNFSCDGZSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50091219   
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
Opioid receptors; mu & delta


(Rattus norvegicus (rat))		BDBM50091219
PNG
(4-[[2,5-Dimethyl-4-(2-methyl-allyl)-piperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1C[C@@H](C)N(CC(C)=C)C[C@@H]1C)c1cccc(OC)c1
Show InChI InChI=1S/C29H41N3O2/c1-8-30(9-2)29(33)25-15-13-24(14-16-25)28(26-11-10-12-27(17-26)34-7)32-20-22(5)31(18-21(3)4)19-23(32)6/h10-17,22-23,28H,3,8-9,18-20H2,1-2,4-7H3/t22-,23+,28?/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 4.80n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Inhibition of [3H]-DADLE binding to rat brain membrane Opioid receptor delta 1

J Med Chem 43: 3193-6 (2000)


BindingDB Entry DOI: 10.7270/Q21835RR
More data for this
Ligand-Target Pair