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SMILES: COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CCCOCOC1

InChI Key: InChIKey=LNGFUEZUSQANCV-DOEKTCAHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 99897   
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


(Human immunodeficiency virus type 1 group M subtyp...)		BDBM99897
PNG
(US8501961, 3a)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CCCOCOC1 |r|
Show InChI InChI=1S/C28H40N2O8S/c1-21(2)17-30(39(33,34)25-13-11-23(35-3)12-14-25)18-27(31)26(16-22-8-5-4-6-9-22)29-28(32)38-24-10-7-15-36-20-37-19-24/h4-6,8-9,11-14,21,24,26-27,31H,7,10,15-20H2,1-3H3,(H,29,32)/t24-,26-,27+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem

Similars
US Patent
 0.150n/an/an/an/an/an/an/an/a



Purdue Research Foundation

US Patent


Assay Description
Enzyme inhibitory assay utilizes a protocol described by Toth and Marshall (Toth, M. V.; Marshall G.R. A simple, continuous fluormetric assay for HIV...

US Patent US8501961 (2013)


BindingDB Entry DOI: 10.7270/Q2TD9VZH
More data for this
Ligand-Target Pair