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BDBM50029990 3-(5-Hydroxy-2,3,8,8-tetramethyl-4-oxo-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl)-3-phenyl-acrylic acid::CHEMBL134236

SMILES: C[C@H]1Oc2c3C=CC(C)(C)Oc3c(C(=CC(O)=O)c3ccccc3)c(O)c2C(=O)[C@H]1C

InChI Key: InChIKey=SSJOJPHKKKSPGS-UONOGXRCSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50029990   
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)
BDBM50029990
PNG
(3-(5-Hydroxy-2,3,8,8-tetramethyl-4-oxo-3,4-dihydro...)
Show SMILES C[C@H]1Oc2c3C=CC(C)(C)Oc3c(C(=CC(O)=O)c3ccccc3)c(O)c2C(=O)[C@H]1C |w:14.15,c:5|
Show InChI InChI=1S/C25H24O6/c1-13-14(2)30-23-16-10-11-25(3,4)31-24(16)19(22(29)20(23)21(13)28)17(12-18(26)27)15-8-6-5-7-9-15/h5-14,29H,1-4H3,(H,26,27)/t13-,14+/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
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