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SMILES: Cc1c(Sc2ccccc2)n(CC=Cc2cccnc2)c(=O)[nH]c1=O

InChI Key: InChIKey=LPZPIJGAMUQQSS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50058299   
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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM50058299
PNG
(5-Methyl-6-phenylsulfanyl-1-((E)-3-pyridin-3-yl-al...)
Show SMILES Cc1c(Sc2ccccc2)n(CC=Cc2cccnc2)c(=O)[nH]c1=O |w:13.14|
Show InChI InChI=1S/C19H17N3O2S/c1-14-17(23)21-19(24)22(12-6-8-15-7-5-11-20-13-15)18(14)25-16-9-3-2-4-10-16/h2-11,13H,12H2,1H3,(H,21,23,24)
PDB
MMDB

UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 100n/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
Inhibitory concentration against HIV-1 reverse transcriptase


J Med Chem 40: 4257-64 (1998)


Article DOI: 10.1021/jm970110p
BindingDB Entry DOI: 10.7270/Q2WS8SC3
More data for this
Ligand-Target Pair