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BDBM50376804 CHEMBL261594

SMILES: CCc1cccc(CC)c1-c1cc(OC)c2C(CCCc2n1)N1CCc2cccc(C(=O)OC)c2C1

InChI Key: InChIKey=AFRYVACYSKMULR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50376804   
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
C5a anaphylatoxin chemotactic receptor (C5aR)


(Homo sapiens (Human))		BDBM50376804
PNG
(CHEMBL261594)
Show SMILES CCc1cccc(CC)c1-c1cc(OC)c2C(CCCc2n1)N1CCc2cccc(C(=O)OC)c2C1 |w:16.24|
Show InChI InChI=1S/C31H36N2O3/c1-5-20-10-7-11-21(6-2)29(20)26-18-28(35-3)30-25(32-26)14-9-15-27(30)33-17-16-22-12-8-13-23(24(22)19-33)31(34)36-4/h7-8,10-13,18,27H,5-6,9,14-17,19H2,1-4H3
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Similars
Article
PubMed
n/an/a 840n/an/an/an/an/an/a



Johnson& Johnson PRD

Curated by ChEMBL


Assay Description
Antagonist activity at human C5a receptor in U937 cells assessed as inhibition of anaphylatoxin-induced intracellular calcium mobilization

Bioorg Med Chem Lett 18: 2544-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.049
BindingDB Entry DOI: 10.7270/Q2JM2BHD
More data for this
Ligand-Target Pair