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BDBM50044908 CHEMBL170006::Phosphoric acid hexadecyl ester 5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethyl ester

SMILES: CCCCCCCCCCCCCCCCOP(O)(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O

InChI Key: InChIKey=CVANKHGHDKEDOL-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50044908   
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)
BDBM50044908
PNG
(CHEMBL170006 | Phosphoric acid hexadecyl ester 5-(...)
Show SMILES CCCCCCCCCCCCCCCCOP(O)(=O)OCC1OC(C=C1)n1cc(C)c(=O)[nH]c1=O |c:25|
Show InChI InChI=1S/C26H45N2O7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33-36(31,32)34-21-23-17-18-24(35-23)28-20-22(2)25(29)27-26(28)30/h17-18,20,23-24H,3-16,19,21H2,1-2H3,(H,31,32)(H,27,29,30)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

PubMed
n/an/an/an/a 200n/an/an/an/a



URA CNRS 1309

Curated by ChEMBL


Assay Description
Effective concentration that reduces HIV-induced cytopathic effect by 50% was determined by reverse transcriptase (RT) assay.


J Med Chem 36: 826-30 (1993)


BindingDB Entry DOI: 10.7270/Q2WW7JBD
More data for this
Ligand-Target Pair