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Compound InformationSONAR Target prediction
Name:

Piceatannol

Unique Identifier:LOPAC 01122
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14H12O4
Molecular Weight:232.147 g/mol
X log p:17.259  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:2
Canonical Smiles:Oc1cc(O)cc(C=Cc2ccc(O)c(O)c2)c1
Class:Phosphorylation
Action:Inhibitor
Selectivity:Syk / Lck

Found: 2 active | as graph: single | with analogs 2 Next >> 
Species: 4932
Condition: NOP13
Replicates: 2
Raw OD Value: r im 0.5007±0.187737
Normalized OD Score: sc h 0.7097±0.261051
Z-Score: -12.8146±10.3383
p-Value: 0.000000018533
Z-Factor: -3.65683
Fitness Defect: 17.8037
Bioactivity Statement: Active
Experimental Conditions
Library:Lopac
Plate Number and Position:12|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-22 YYYY-MM-DD
Plate CH Control (+):0.0469±0.00117
Plate DMSO Control (-):0.698±0.08139
Plate Z-Factor:0.6415
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DBLink | Rows returned: 3
4813 4-[2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol
667639 4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol
6603962 4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol

internal high similarity DBLink | Rows returned: 3
SPE00201066 0.9250
SPE01502223 0.9750
LOPAC 00461 0.9762

nonactive | Cluster 1910 | Additional Members: 8 | Rows returned: 5
SPE01504044 0.394736842105263
SPE00201066 0.352941176470588
LOPAC 00461 0
Prest619 0
SPE01502223 0

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