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BDBM50029991 Acetic acid 2,3,10,10-tetramethyl-6-oxo-8-phenyl-3,4-dihydro-2H,6H,10H-dipyrano[2,3-f;2',3'-h]chromen-4-yl ester::CHEMBL132986

SMILES: C[C@H]1Oc2c3C=CC(C)(C)Oc3c3c(cc(=O)oc3c2[C@H](OC(C)=O)[C@@H]1C)-c1ccccc1

InChI Key: InChIKey=DDHWWLULUFLVOI-GGOJBBCOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50029991   
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)
BDBM50029991
PNG
(Acetic acid 2,3,10,10-tetramethyl-6-oxo-8-phenyl-3...)
Show SMILES C[C@H]1Oc2c3C=CC(C)(C)Oc3c3c(cc(=O)oc3c2[C@H](OC(C)=O)[C@@H]1C)-c1ccccc1 |c:5|
Show InChI InChI=1S/C27H26O6/c1-14-15(2)30-24-18-11-12-27(4,5)33-25(18)21-19(17-9-7-6-8-10-17)13-20(29)32-26(21)22(24)23(14)31-16(3)28/h6-15,23H,1-5H3/t14-,15-,23-/m1/s1
PDB
MMDB

UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

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



SmithKline Beecham Pharmaceuticals R& D

Curated by ChEMBL


Assay Description
Inhibitory concentration against HIV-1 reverse transcriptase in scintillation proximity assay


J Med Chem 36: 4131-8 (1994)


BindingDB Entry DOI: 10.7270/Q269746K
More data for this
Ligand-Target Pair