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BDBM50325054 (1S,4S)-2-((1-benzyl-1H-tetrazol-5-yl)(4-fluorophenyl)methyl)-5-cyclobutyl-2,5-diazabicyclo[2.2.1]heptane::CHEMBL1223008

SMILES: Fc1ccc(cc1)C(N1C[C@@H]2C[C@H]1CN2C1CCC1)c1nnnn1Cc1ccccc1

InChI Key: InChIKey=QJZHGLMHUFXFNJ-OJSMNCEXSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50325054   
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))
BDBM50325054
PNG
((1S,4S)-2-((1-benzyl-1H-tetrazol-5-yl)(4-fluorophe...)
Show SMILES Fc1ccc(cc1)C(N1C[C@@H]2C[C@H]1CN2C1CCC1)c1nnnn1Cc1ccccc1 |r|
Show InChI InChI=1S/C24H27FN6/c25-19-11-9-18(10-12-19)23(24-26-27-28-31(24)14-17-5-2-1-3-6-17)30-16-21-13-22(30)15-29(21)20-7-4-8-20/h1-3,5-6,9-12,20-23H,4,7-8,13-16H2/t21-,22-,23?/m0/s1
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Similars

Article
PubMed
n/an/a 241n/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