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SMILES: O[C@H]([C@@H](O)[C@@H](OCc1ccccc1)C(=O)NCc1ccccn1)[C@@H](OCc1ccccc1)C(=O)NCc1ccccn1

InChI Key: InChIKey=WYYNQGNVYFOKTM-SKKKGAJSSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50121524   
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)		BDBM50121524
PNG
((2R,3R,4R,5R)-2,5-Bis-benzyloxy-3,4-dihydroxy-hexa...)
Show SMILES O[C@H]([C@@H](O)[C@@H](OCc1ccccc1)C(=O)NCc1ccccn1)[C@@H](OCc1ccccc1)C(=O)NCc1ccccn1
Show InChI InChI=1S/C32H34N4O6/c37-27(29(41-21-23-11-3-1-4-12-23)31(39)35-19-25-15-7-9-17-33-25)28(38)30(42-22-24-13-5-2-6-14-24)32(40)36-20-26-16-8-10-18-34-26/h1-18,27-30,37-38H,19-22H2,(H,35,39)(H,36,40)/t27-,28-,29-,30-/m1/s1
PDB
MMDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Association rate constant for the interaction between inhibitor and HIV-1 protease

J Med Chem 45: 5430-9 (2002)


BindingDB Entry DOI: 10.7270/Q2GH9JP4
More data for this
Ligand-Target Pair