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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 2A' and Ligand = 'BDBM50422022'   
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 2A


(Rattus norvegicus (rat))		BDBM50422022
PNG
(CHEMBL101138)
Show SMILES CN(C)CCc1c[nH]c2ccc(cc12)N1CCN(Cc2ccccc2)S1(=O)=O
Show InChI InChI=1S/C21H26N4O2S/c1-23(2)11-10-18-15-22-21-9-8-19(14-20(18)21)25-13-12-24(28(25,26)27)16-17-6-4-3-5-7-17/h3-9,14-15,22H,10-13,16H2,1-2H3
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PubMed
n/an/a 5.01E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]DOB binding to 5-hydroxytryptamine 2A receptor from rat cortex homogenate

J Med Chem 37: 3023-32 (1994)


BindingDB Entry DOI: 10.7270/Q2V69KWJ
More data for this
Ligand-Target Pair