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BDBM50182271 CHEMBL3818269

SMILES: Oc1c(NC(=O)Nc2cccc(Cl)c2Cl)ccc(Cl)c1S(=O)(=O)C1CCNCC1

InChI Key: InChIKey=TUVWJDWURVHYQT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50182271   
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
C-X-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50182271
PNG
(CHEMBL3818269)
Show SMILES Oc1c(NC(=O)Nc2cccc(Cl)c2Cl)ccc(Cl)c1S(=O)(=O)C1CCNCC1
Show InChI InChI=1S/C18H18Cl3N3O4S/c19-11-2-1-3-13(15(11)21)23-18(26)24-14-5-4-12(20)17(16(14)25)29(27,28)10-6-8-22-9-7-10/h1-5,10,22,25H,6-9H2,(H2,23,24,26)
PDB

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PC sid
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Similars

PubMed
n/an/a 2n/an/an/an/an/an/a



Peking Union Medical College and Chinese Academy of Medical Sciences

Curated by ChEMBL


Assay Description
Antagonist activity at human recombinant Gal4-VP16 fused-CXCR2 assessed as inhibition of CXCL1-mediated lactamase reporter gene expression after over...


ACS Med Chem Lett 7: 397-402 (2016)


BindingDB Entry DOI: 10.7270/Q2KW5HZH
More data for this
Ligand-Target Pair