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SMILES: CCNC(=O)c1noc(c1NC(=O)c1nc(C)c(s1)-c1ccc(F)cc1)-c1cc(C(C)C)c(O)cc1O

InChI Key: InChIKey=ZBLJDTBAHMXIQE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50361718   
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
Heat shock protein HSP 90-beta


(Homo sapiens (Human))		BDBM50361718
PNG
(CHEMBL1941067)
Show SMILES CCNC(=O)c1noc(c1NC(=O)c1nc(C)c(s1)-c1ccc(F)cc1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H25FN4O5S/c1-5-28-24(34)21-20(22(36-31-21)17-10-16(12(2)3)18(32)11-19(17)33)30-25(35)26-29-13(4)23(37-26)14-6-8-15(27)9-7-14/h6-12,32-33H,5H2,1-4H3,(H,28,34)(H,30,35)
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Similars
Article
PubMed
n/an/a 40n/an/an/an/an/an/a



Universit£ degli Studi di Ferrara

Curated by ChEMBL


Assay Description
Binding affinity to Hsp90 after 4 hrs by fluorescence polarization assay

J Med Chem 54: 8592-604 (2011)


Article DOI: 10.1021/jm201155e
BindingDB Entry DOI: 10.7270/Q2QF8T9M
More data for this
Ligand-Target Pair