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BDBM50529273 CHEMBL4556553

SMILES: [#8]-[#6](-[#6]-[#8]-c1ccccc1F)-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1\c2ccc(Cl)cc2-[#6]-[#6]-c2cccnc-12

InChI Key: InChIKey=QDKKXAVDAGWZNP-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50529273   
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 H1 receptor


(Homo sapiens (Human))		BDBM50529273
PNG
(CHEMBL4556553)
Show SMILES [#8]-[#6](-[#6]-[#8]-c1ccccc1F)-[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1\c2ccc(Cl)cc2-[#6]-[#6]-c2cccnc-12
Show InChI InChI=1S/C28H28ClFN2O2/c29-22-9-10-24-21(16-22)8-7-20-4-3-13-31-28(20)27(24)19-11-14-32(15-12-19)17-23(33)18-34-26-6-2-1-5-25(26)30/h1-6,9-10,13,16,23,33H,7-8,11-12,14-15,17-18H2
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PC cid
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Article
PubMed
n/an/a 4.70n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H1 receptor (unknown origin)

Bioorg Med Chem Lett 29: (2019)


Article DOI: 10.1016/j.bmcl.2019.126712
More data for this
Ligand-Target Pair