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BDBM50133186 CHEMBL132626::Dipropyl-(5,6,7,8-tetrahydro-naphthalen-2-yl)-amine::N,N-dipropyl-N-5,6,7,8-tetrahydronaphthalen-2-ylamine

SMILES: CCCN(CCC)c1ccc2CCCCc2c1

InChI Key: InChIKey=NIAGNBAOEWXBKS-UHFFFAOYSA-N

Data: 1 KI

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   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 = 50133186   
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
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50133186
PNG
(CHEMBL132626 | Dipropyl-(5,6,7,8-tetrahydro-naphth...)
Show SMILES CCCN(CCC)c1ccc2CCCCc2c1
Show InChI InChI=1S/C16H25N/c1-3-11-17(12-4-2)16-10-9-14-7-5-6-8-15(14)13-16/h9-10,13H,3-8,11-12H2,1-2H3
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University Center for Pharmacy

Curated by ChEMBL


Assay Description
In vitro binding affinity of the compound towards Dopamine receptor D2


J Med Chem 46: 4136-40 (2003)


Article DOI: 10.1021/jm0307786
BindingDB Entry DOI: 10.7270/Q2M61JP7
More data for this
Ligand-Target Pair