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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor' and Ligand = 'BDBM50010644'   
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 D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50010644
PNG
((S)-3-Bromo-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2,5-...)
Show SMILES Cl.CCN1CCC[C@H]1CNC(=O)c1c(O)c(Br)cc(O)c1OC
Show InChI InChI=1S/C15H21BrN2O4.ClH/c1-3-18-6-4-5-9(18)8-17-15(21)12-13(20)10(16)7-11(19)14(12)22-2;/h7,9,19-20H,3-6,8H2,1-2H3,(H,17,21);1H/t9-;/m0./s1
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PC sid
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Similars

Article
PubMed
n/an/a 1.90n/an/an/an/an/an/a



Astra Research Centre AB

Curated by ChEMBL


Assay Description
In vitro ability to inhibit the binding of [3H]spiperone to dopamine receptor D2 in rat striatal membranes.


J Med Chem 33: 1155-63 (1990)


Article DOI: 10.1021/jm00166a012
BindingDB Entry DOI: 10.7270/Q24X58DR
More data for this
Ligand-Target Pair