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SMILES: CC(C)CN([C@H](CO)CCCCNC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1F)S(=O)(=O)c1ccc(N)cc1

InChI Key: InChIKey=ZKWKOYXTTRVTSM-NDEPHWFRSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 9822   
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
Dimer of Gag-Pol polyprotein [501-599]


(Human immunodeficiency virus type 1)		BDBM9822
PNG
(3-[(5S)-5-[(4-aminobenzene)(2-methylpropyl)sulfona...)
Show SMILES CC(C)CN([C@H](CO)CCCCNC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1F)S(=O)(=O)c1ccc(N)cc1 |r|
Show InChI InChI=1S/C31H40F2N4O4S/c1-23(2)19-37(42(40,41)29-15-13-27(34)14-16-29)28(22-38)10-6-7-17-35-31(39)36(20-24-8-4-3-5-9-24)21-25-11-12-26(32)18-30(25)33/h3-5,8-9,11-16,18,23,28,38H,6-7,10,17,19-22,34H2,1-2H3,(H,35,39)/t28-/m0/s1
PDB
MMDB

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PC cid
PC sid
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Similars
Article
PubMed
 12n/an/an/an/an/an/an/an/a



Procyon Biopharma Inc.



Assay Description
HIV-1 protease activity was measured by a continuous fluorometric assay using the internally quenched fluorogenic substrate DABCYL-Ser-Gln-Asn-Tyr-Pr...

Bioorg Med Chem Lett 14: 3971-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.049
BindingDB Entry DOI: 10.7270/Q22V2DB2
More data for this
Ligand-Target Pair