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BDBM50233575 5-(1-(2-(3-(dimethylcarbamoyl)-2-hydroxyphenylamino)-3,4-dioxocyclobut-1-enylamino)propyl)-N,N-dimethylfuran-2-carboxamide::CHEMBL253255

SMILES: CCC(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1ccc(o1)C(=O)N(C)C

InChI Key: InChIKey=PHXRSGRVCIOASS-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50233575   
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))
BDBM50233575
PNG
(5-(1-(2-(3-(dimethylcarbamoyl)-2-hydroxyphenylamin...)
Show SMILES CCC(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1ccc(o1)C(=O)N(C)C |w:2.2|
Show InChI InChI=1S/C23H26N4O6/c1-6-13(15-10-11-16(33-15)23(32)27(4)5)24-17-18(21(30)20(17)29)25-14-9-7-8-12(19(14)28)22(31)26(2)3/h7-11,13,24-25,28H,6H2,1-5H3
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Similars

Article
PubMed
n/an/a 171n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibition of CXCR2


Bioorg Med Chem Lett 18: 1318-22 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.024
BindingDB Entry DOI: 10.7270/Q2PV6K33
More data for this
Ligand-Target Pair