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BDBM50225714 1-(1-(((1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl)piperidin-4-yl)-3-(3-fluoro-5-(trifluoromethyl)phenyl)imidazolidin-2-one::CHEMBL249605

SMILES: CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)N1CCN(C1=O)c1cc(F)cc(c1)C(F)(F)F)=CC2

InChI Key: InChIKey=VGKWHTUGPLDPNK-JTSKRJEESA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50225714   
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
chemokine (C-X-C motif) receptor 3


(Homo sapiens (Human))
BDBM50225714
PNG
(1-(1-(((1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-2-en...)
Show SMILES CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)N1CCN(C1=O)c1cc(F)cc(c1)C(F)(F)F)=CC2 |c:34|
Show InChI InChI=1S/C25H31F4N3O/c1-24(2)17-4-3-16(22(24)13-17)15-30-7-5-20(6-8-30)31-9-10-32(23(31)33)21-12-18(25(27,28)29)11-19(26)14-21/h3,11-12,14,17,20,22H,4-10,13,15H2,1-2H3/t17-,22-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
200n/an/an/an/an/an/an/an/a



UCB Inflammation Discovery

Curated by ChEMBL


Assay Description
Binding affinity to human CXCR3 receptor expressed in CHO membrane by ITAC-stimulated GTP gammaS assay


Bioorg Med Chem Lett 17: 6806-10 (2007)


Article DOI: 10.1016/j.bmcl.2007.10.029
BindingDB Entry DOI: 10.7270/Q24F1QGP
More data for this
Ligand-Target Pair