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SMILES: CC(Nc1ccccc1)c1ccc(cc1)C(C)Nc1ccccc1

InChI Key: InChIKey=LESHUEYGKQTRAQ-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 194516   
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 4


(Rattus norvegicus (Rat))
BDBM194516
PNG
(US9205085, MSX- 169)
Show SMILES CC(Nc1ccccc1)c1ccc(cc1)C(C)Nc1ccccc1
Show InChI InChI=1S/C22H24N2/c1-17(23-21-9-5-3-6-10-21)19-13-15-20(16-14-19)18(2)24-22-11-7-4-8-12-22/h3-18,23-24H,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



Emory University

US Patent


Assay Description
A synthetic 14-mer peptide, TN14003, was previously reported to block both SDF-1/CXCR4 mediated invasion in vitro and metastasis in vivo with a high ...


US Patent US9205085 (2015)


BindingDB Entry DOI: 10.7270/Q2FF3R5M
More data for this
Ligand-Target Pair