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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 = 'BDBM50475895'   
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))
BDBM50475895
PNG
(CHEMBL385254)
Show SMILES COc1cc(NC(=O)c2ccc(cc2)-c2ccccc2)ccc1OCCN(C(C)C)C(C)C
Show InChI InChI=1S/C28H34N2O3/c1-20(2)30(21(3)4)17-18-33-26-16-15-25(19-27(26)32-5)29-28(31)24-13-11-23(12-14-24)22-9-7-6-8-10-22/h6-16,19-21H,17-18H2,1-5H3,(H,29,31)
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PC cid
PC sid
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Article
PubMed
158n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to 5HT2C receptor


Bioorg Med Chem Lett 16: 4865-71 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.056
BindingDB Entry DOI: 10.7270/Q2F192GH
More data for this
Ligand-Target Pair