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Compound InformationSONAR Target prediction
Name:

Thalidomide

Unique Identifier:Prest463
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13H10N2O4
Molecular Weight:248.15 g/mol
X log p:6.737  (online calculus)
Lipinksi Failures1
TPSA71.52
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:1
Canonical Smiles:O=C1CCC(n2c(=O)c3ccccc3c2=O)C(=O)N1

Found: 3 nonactive as graph: single | with analogs << Back 1 2 3
Species: 9606
Condition: TMPPre003
Replicates: 2
Raw OD Value: r im 17444.0000±0
Normalized OD Score: sc h 0.9264±0
Z-Score: -2.0481±0
p-Value: 0.0405506
Z-Factor: -3.2841
Fitness Defect: 3.2052
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:3|D3
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.60 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):18357.5±2177.01332
Plate DMSO Control (-):18529.5±1551.44299
Plate Z-Factor:-61.5880
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DBLink | Rows returned: 1
5426 2-(2,6-dioxo-3-piperidyl)isoindole-1,3-dione

internal high similarity DBLink | Rows returned: 0

active | Cluster 7702 | Additional Members: 4 | Rows returned: 0

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