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BDBM50369542 CHEMBL611850

SMILES: CCCCCCCC(=O)Nc1nn(C)c2ncnc3n(cc1c23)C1O[C@H](CO)[C@@H](O)[C@H]1O

InChI Key: InChIKey=AKVUSGVIDMXJFH-MVMYICEXSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50369542   
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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50369542
PNG
(CHEMBL611850)
Show SMILES CCCCCCCC(=O)Nc1nn(C)c2ncnc3n(cc1c23)C1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C21H30N6O5/c1-3-4-5-6-7-8-14(29)24-18-12-9-27(21-17(31)16(30)13(10-28)32-21)20-15(12)19(22-11-23-20)26(2)25-18/h9,11,13,16-17,21,28,30-31H,3-8,10H2,1-2H3,(H,24,25,29)/t13-,16-,17-,21?/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

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



University of Michigan

Curated by ChEMBL


Assay Description
Antiviral activity was evaluated by Reverse transcriptase activity in cells acutely infected with HIV-1


J Med Chem 43: 2457-63 (2000)


BindingDB Entry DOI: 10.7270/Q22N52Z2
More data for this
Ligand-Target Pair