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SMILES: OC(=O)C(OC(=O)CCc1ccc(O)c(O)c1)C(OC(=O)CCc1ccc(O)c(O)c1)C(O)=O

InChI Key: InChIKey=LSABLHXNDXJOIS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50073640   
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
Integrase


(Human immunodeficiency virus 1)		BDBM50073640
PNG
(2,3-Bis-[3-(3,4-dihydroxy-phenyl)-propionyloxy]-su...)
Show SMILES OC(=O)C(OC(=O)CCc1ccc(O)c(O)c1)C(OC(=O)CCc1ccc(O)c(O)c1)C(O)=O
Show InChI InChI=1S/C22H22O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-2,5-6,9-10,19-20,23-26H,3-4,7-8H2,(H,29,30)(H,31,32)
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UniChem

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PubMed
n/an/a 2.38E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity against Human Immunodeficiency Virus Type 1 integrase (HIV-1 IN) in the disintegration assay.

J Med Chem 42: 497-509 (1999)


Article DOI: 10.1021/jm9804735
BindingDB Entry DOI: 10.7270/Q2G161J5
More data for this
Ligand-Target Pair