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BDBM50321087 CHEMBL1164167::N-propyl-N-3-(4-nitrophenyl)-ethylamine

SMILES: CCCNCCc1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=ODYUCBYYPNQUGB-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50321087   
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
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50321087
PNG
(CHEMBL1164167 | N-propyl-N-3-(4-nitrophenyl)-ethyl...)
Show SMILES CCCNCCc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C11H16N2O2/c1-2-8-12-9-7-10-3-5-11(6-4-10)13(14)15/h3-6,12H,2,7-9H2,1H3
PDB

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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.25E+3n/an/an/an/an/an/an/an/a



University of Wisconsin School of Medicine and Public Health

Curated by ChEMBL


Assay Description
Displacement of (+)-[3H]pentazocine from sigma 1 receptor in guinea pig liver homogenates after 1 hr by liquid scintillation counting


Bioorg Med Chem 18: 4397-404 (2010)


Article DOI: 10.1016/j.bmc.2010.04.078
BindingDB Entry DOI: 10.7270/Q20C4VZT
More data for this
Ligand-Target Pair