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BDBM1914 1-[2-(2-fluoro-6-methoxyphenyl)ethyl]-3-1,3-thiazol-2-ylthiourea::N-(2-(2-Fluoro-6-methoxyphenethyl))-N -(2-thiazolyl)thiourea::PETT Analog 21

SMILES: COc1cccc(F)c1CCNC(=S)Nc1nccs1

InChI Key: InChIKey=MCJWFYQBNIPBAD-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 1914   
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
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1914
PNG
(1-[2-(2-fluoro-6-methoxyphenyl)ethyl]-3-1,3-thiazo...)
Show SMILES COc1cccc(F)c1CCNC(=S)Nc1nccs1
Show InChI InChI=1S/C13H14FN3OS2/c1-18-11-4-2-3-10(14)9(11)5-6-15-12(19)17-13-16-7-8-20-13/h2-4,7-8H,5-6H2,1H3,(H2,15,16,17,19)
PDB
MMDB

B.MOAD
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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Lilly Research Laboratories



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 38: 4929-36 (1995)


Article DOI: 10.1021/jm0503704
BindingDB Entry DOI: 10.7270/Q2639MXG
More data for this
Ligand-Target Pair