new BindingDB logo
myBDB logout

BDBM2870 3-(5-bromopyridin-2-yl)-1-[3-(2,6-difluorophenyl)-3-oxopropyl]thiourea::PETT deriv. 20

SMILES: Fc1cccc(F)c1C(=O)CCNC(=S)Nc1ccc(Br)cn1

InChI Key: InChIKey=BOOFKKBANNNNAY-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 2870   
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)
BDBM2870
PNG
(3-(5-bromopyridin-2-yl)-1-[3-(2,6-difluorophenyl)-...)
Show SMILES Fc1cccc(F)c1C(=O)CCNC(=S)Nc1ccc(Br)cn1
Show InChI InChI=1S/C15H12BrF2N3OS/c16-9-4-5-13(20-8-9)21-15(23)19-7-6-12(22)14-10(17)2-1-3-11(14)18/h1-5,8H,6-7H2,(H2,19,20,21,23)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3n/an/an/an/a7.837



Medivir AB



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.


Bioorg Med Chem Lett 10: 265-8 (2000)


Article DOI: 10.1021/jm050896o
BindingDB Entry DOI: 10.7270/Q2DF6PDR
More data for this
Ligand-Target Pair