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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serotonin 2 (5-HT2) receptor' and Ligand = 'BDBM50001997'   
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
Serotonin 2 (5-HT2) receptor


(RAT-Rattus norvegicus (Rat)-Rattus norvegicus (rat...)		BDBM50001997
PNG
(1-(2-{4-[1-(4-Fluoro-phenyl)-5-trifluoromethyl-1H-...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C25H26F4N4O/c26-19-2-4-20(5-3-19)33-16-22(21-15-18(25(27,28)29)1-6-23(21)33)17-7-10-31(11-8-17)13-14-32-12-9-30-24(32)34/h1-6,15-17H,7-14H2,(H,30,34)
PDB

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PC cid
PC sid
UniChem

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PubMed
n/an/a 1n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Inhibition of [3H]ketanserin binding to rat 5-hydroxytryptamine 2 receptors.

J Med Chem 35: 1092-101 (1992)


BindingDB Entry DOI: 10.7270/Q2Z89BB3
More data for this
Ligand-Target Pair