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BDBM3135 2-pyridinone deriv. 41::5-ethyl-3-{[(3-methoxyphenyl)methyl]amino}-6-methyl-1,2-dihydropyridin-2-one

SMILES: CCc1cc(NCc2cccc(OC)c2)c(=O)[nH]c1C

InChI Key: InChIKey=KLRXTTMCXPTAGO-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 3135   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM3135
PNG
(2-pyridinone deriv. 41 | 5-ethyl-3-{[(3-methoxyphe...)
Show SMILES CCc1cc(NCc2cccc(OC)c2)c(=O)[nH]c1C
Show InChI InChI=1S/C16H20N2O2/c1-4-13-9-15(16(19)18-11(13)2)17-10-12-6-5-7-14(8-12)20-3/h5-9,17H,4,10H2,1-3H3,(H,18,19)
PDB
MMDB

GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.25E+3n/an/an/an/a8.2n/a



Merck 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 36: 249-55 (1993)


Article DOI: 10.1021/jm00054a009
BindingDB Entry DOI: 10.7270/Q20863HM
More data for this
Ligand-Target Pair