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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-X-C chemokine receptor type 2' and Ligand = 'BDBM50248502'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50248502
PNG
((S)-3-(2-(1-(4-chlorofuran-2-yl)-2,2,2-trifluoroet...)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3cc(Cl)co3)C(F)(F)F)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C19H15ClF3N3O5/c1-26(2)18(30)9-4-3-5-10(14(9)27)24-12-13(16(29)15(12)28)25-17(19(21,22)23)11-6-8(20)7-31-11/h3-7,17,24-25,27H,1-2H3/t17-/m0/s1
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Article
PubMed
5n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to CXCR2 (unknown origin)


Bioorg Med Chem Lett 19: 1431-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.01.033
BindingDB Entry DOI: 10.7270/Q2CV4HMF
More data for this
Ligand-Target Pair