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Compound InformationSONAR Target prediction
Name:

(±)-Thalidomide

Unique Identifier:LOPAC 01279
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
Class:Cytoskeleton and ECM
Action:Inhibitor
Selectivity:TNFalpha

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 Next >> [24]
Species: 4932
Condition: TEP1
Replicates: 2
Raw OD Value: r im 0.6227±0.0435578
Normalized OD Score: sc h 1.0055±0.0271551
Z-Score: 0.3095±1.12284
p-Value: 0.448936
Z-Factor: -347.224
Fitness Defect: 0.8009
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:16|C5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-05-17 YYYY-MM-DD
Plate CH Control (+):0.045649999999999996±0.00133
Plate DMSO Control (-):0.5635±0.02611
Plate Z-Factor:0.7763
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

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