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SMILES: CN1CCN2C(C1)c1ccccc1Cc1cccc(OS(=O)(=O)C(F)(F)F)c21

InChI Key: InChIKey=DIQWXIJCKNFULQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50115645   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))		BDBM50115645
PNG
((+/-)-8Trifluoro-methanesulfonic acid 2-methyl-1,2...)
Show SMILES CN1CCN2C(C1)c1ccccc1Cc1cccc(OS(=O)(=O)C(F)(F)F)c21
Show InChI InChI=1S/C19H19F3N2O3S/c1-23-9-10-24-16(12-23)15-7-3-2-5-13(15)11-14-6-4-8-17(18(14)24)27-28(25,26)19(20,21)22/h2-8,16H,9-12H2,1H3
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PC cid
PC sid
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PubMed
 277n/an/an/an/an/an/an/an/a



University Center for Pharmacy

Curated by ChEMBL


Assay Description
The binding affinity of the compound at 5-hydroxytryptamine 2A receptor was determined using [3H]-ketanserin

J Med Chem 45: 3280-5 (2002)


BindingDB Entry DOI: 10.7270/Q28051ZZ
More data for this
Ligand-Target Pair