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SMILES: COc1ccc2nc(N3CCCC(N)C3)n(Cc3ccccc3C(F)(F)F)c2c1F

InChI Key: InChIKey=CZSRBTBSPLWAAW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 13801   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))		BDBM13801
PNG
(1-(7-fluoro-6-methoxy-1-{[2-(trifluoromethyl)pheny...)
Show SMILES COc1ccc2nc(N3CCCC(N)C3)n(Cc3ccccc3C(F)(F)F)c2c1F
Show InChI InChI=1S/C21H22F4N4O/c1-30-17-9-8-16-19(18(17)22)29(20(27-16)28-10-4-6-14(26)12-28)11-13-5-2-3-7-15(13)21(23,24)25/h2-3,5,7-9,14H,4,6,10-12,26H2,1H3
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MMDB

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Article
PubMed
 57 -9.78n/an/an/an/an/a7.522



Abbott Laboratories



Assay Description
The DPP activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 355 nm and meas...

Bioorg Med Chem Lett 16: 6226-30 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.024
BindingDB Entry DOI: 10.7270/Q2MP51H4
More data for this
Ligand-Target Pair