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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dopamine receptors; D2 & D4' and Ligand = 'BDBM50213852'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine receptors; D2 & D4


(Homo sapiens (Human))
BDBM50213852
PNG
(CHEMBL21059)
Show SMILES CC(C)(C)C(=O)NCCCCN1CCN(CC1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H30F3N3O/c1-19(2,3)18(27)24-10-4-5-11-25-12-14-26(15-13-25)17-8-6-16(7-9-17)20(21,22)23/h6-9H,4-5,10-15H2,1-3H3,(H,24,27)
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KEGG

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

50n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity at cloned human Dopamine receptor D4 expressed in HEK 293 cells, using [3H]nemonapride as radioligand


Citation and Details

BindingDB Entry DOI: 10.7270/Q2639RWP
More data for this
Ligand-Target Pair