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BDBM50325050 1-((1-benzyl-1H-tetrazol-5-yl)(4-fluorophenyl)methyl)-4-cyclopentyl-1,4-diazepane::CHEMBL1222945

SMILES: Fc1ccc(cc1)C(N1CCCN(CC1)C1CCCC1)c1nnnn1Cc1ccccc1

InChI Key: InChIKey=JPKXYHFSWDFHJS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50325050   
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
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50325050
PNG
(1-((1-benzyl-1H-tetrazol-5-yl)(4-fluorophenyl)meth...)
Show SMILES Fc1ccc(cc1)C(N1CCCN(CC1)C1CCCC1)c1nnnn1Cc1ccccc1
Show InChI InChI=1S/C25H31FN6/c26-22-13-11-21(12-14-22)24(25-27-28-29-32(25)19-20-7-2-1-3-8-20)31-16-6-15-30(17-18-31)23-9-4-5-10-23/h1-3,7-8,11-14,23-24H,4-6,9-10,15-19H2
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Article
PubMed
n/an/a 356n/an/an/an/an/an/a



Evotec (UK) Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human histamine H3 receptor


Bioorg Med Chem Lett 20: 5165-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.009
BindingDB Entry DOI: 10.7270/Q2TQ61RV
More data for this
Ligand-Target Pair