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Compound InformationSONAR Target prediction
Name:

Norcantharidin

Unique Identifier:LOPAC 01099
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8H8O4
Molecular Weight:160.083 g/mol
X log p:-0.299  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:O=C1OC(=O)C2C3CCC(O3)C21
Class:Phosphorylation
Action:Inhibitor
Selectivity:PP2A

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: GIM3
Replicates: 4
Raw OD Value: r im 0.4684±0.109679
Normalized OD Score: sc h 1.0283±0.0207183
Z-Score: 0.6147±0.40017
p-Value: 0.543292
Z-Factor: -3.48394
Fitness Defect: 0.6101
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:11|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.044700000000000004±0.00051
Plate DMSO Control (-):0.6080625±0.12359
Plate Z-Factor:0.1665
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DBLink | Rows returned: 23<< Back 1 2 3 4 Next >> 
305445 n/a
3032278 n/a
3038026 n/a
3503030 3-(oxolan-2-yl)oxolane-2,5-dione
3565036 n/a
4231679 n/a

internal high similarity DBLink | Rows returned: 3
LOPAC 00793 1.0000
SPE01500814 1.0000
SPE01504153 1.0000

active | Cluster 564 | Additional Members: 4 | Rows returned: 1
SPE01504153 0

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