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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'D(2) dopamine receptor' and Ligand = 'BDBM50119988'   
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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50119988
PNG
(2-[4-(2,5-Dimethoxy-benzyl)-piperazin-1-yl]-1-((R)...)
Show SMILES COc1ccc(OC)c(CN2CCN(CC(=O)N3[C@H](C)Cc4ccccc34)CC2)c1
Show InChI InChI=1S/C24H31N3O3/c1-18-14-19-6-4-5-7-22(19)27(18)24(28)17-26-12-10-25(11-13-26)16-20-15-21(29-2)8-9-23(20)30-3/h4-9,15,18H,10-14,16-17H2,1-3H3/t18-/m1/s1
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PubMed
59n/an/an/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Binding affinity towards Dopamine type 2 receptor was determined by displacement assays using [3H]-YM 09151 as the competitive ligand


Bioorg Med Chem Lett 12: 3111-5 (2002)


BindingDB Entry DOI: 10.7270/Q2DZ07ND
More data for this
Ligand-Target Pair