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BDBM50288059 3-Benzyloxycarbonyl-3-hydroxy-pentanedioic acid benzyl ester 5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethyl ester::CHEMBL311270

SMILES: Cc1cn(C2OC(COC(=O)CC(O)(CC(=O)OCc3ccccc3)C(=O)OCc3ccccc3)C=C2)c(=O)[nH]c1=O

InChI Key: InChIKey=MQPORVKQALABIR-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50288059   
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)
BDBM50288059
PNG
(3-Benzyloxycarbonyl-3-hydroxy-pentanedioic acid be...)
Show SMILES Cc1cn(C2OC(COC(=O)CC(O)(CC(=O)OCc3ccccc3)C(=O)OCc3ccccc3)C=C2)c(=O)[nH]c1=O |c:37|
Show InChI InChI=1S/C30H30N2O10/c1-20-16-32(29(37)31-27(20)35)24-13-12-23(42-24)19-40-26(34)15-30(38,28(36)41-18-22-10-6-3-7-11-22)14-25(33)39-17-21-8-4-2-5-9-21/h2-13,16,23-24,38H,14-15,17-19H2,1H3,(H,31,35,37)
PDB
MMDB

UniProtKB/TrEMBL

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

Similars

Article
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 reverse transcriptase.


Bioorg Med Chem Lett 6: 2405-2410 (1996)


Article DOI: 10.1016/0960-894X(96)00444-1
BindingDB Entry DOI: 10.7270/Q2Z31ZMC
More data for this
Ligand-Target Pair