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SMILES: COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

InChI Key: InChIKey=ODNJAESPMSUTAB-WUFINQPMSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50288806   
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
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM50288806
PNG
(CHEMBL336684 | {(1S,2R)-1-Benzyl-2-hydroxy-3-[isob...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C29H36N2O6S/c1-22(2)19-31(38(34,35)26-16-14-25(36-3)15-17-26)20-28(32)27(18-23-10-6-4-7-11-23)30-29(33)37-21-24-12-8-5-9-13-24/h4-17,22,27-28,32H,18-21H2,1-3H3,(H,30,33)/t27-,28+/m0/s1
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PC cid
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Article
n/an/a 3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 protease in spectrofluorometric assay

Bioorg Med Chem Lett 6: 445-450 (1996)


Article DOI: 10.1016/0960-894X(96)00035-2
BindingDB Entry DOI: 10.7270/Q2R78F6Z
More data for this
Ligand-Target Pair