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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2C' and Ligand = 'BDBM50412131'   
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
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50412131
PNG
(CHEMBL522708)
Show SMILES Cc1ccc2c(OCCN3CCC(Cc4cccc(c4)N4CCCS4(=O)=O)CC3)cccc2n1
Show InChI InChI=1S/C27H33N3O3S/c1-21-9-10-25-26(28-21)7-3-8-27(25)33-17-16-29-14-11-22(12-15-29)19-23-5-2-6-24(20-23)30-13-4-18-34(30,31)32/h2-3,5-10,20,22H,4,11-19H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
<3.98E+3n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of radioligand from human cloned 5HT2C receptor


J Med Chem 51: 2887-90 (2008)


Article DOI: 10.1021/jm8001444
BindingDB Entry DOI: 10.7270/Q2DV1M4K
More data for this
Ligand-Target Pair