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SMILES: CCCCc1cc(=O)oc2cc(C)cc(OCC(=O)N3CCC(CC3)C(O)=O)c12

InChI Key: InChIKey=AOSOHBROROWIHR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 100146   
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
Kallikrein-7


(Homo sapiens (Human))		BDBM100146
PNG
(1-[2-(4-butyl-2-keto-7-methyl-chromen-5-yl)oxyacet...)
Show SMILES CCCCc1cc(=O)oc2cc(C)cc(OCC(=O)N3CCC(CC3)C(O)=O)c12
Show InChI InChI=1S/C22H27NO6/c1-3-4-5-16-12-20(25)29-18-11-14(2)10-17(21(16)18)28-13-19(24)23-8-6-15(7-9-23)22(26)27/h10-12,15H,3-9,13H2,1-2H3,(H,26,27)
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MMDB

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PCBioAssay
n/an/an/an/a>7.72E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q29G5KF0
More data for this
Ligand-Target Pair