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Compound InformationSONAR Target prediction
Name:

ROSIGLITAZONE

Unique Identifier:SPE01504263
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:338.277 g/mol
X log p:17.026  (online calculus)
Lipinksi Failures1
TPSA84.27
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:7
Canonical Smiles:CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccn1
Source:synthetic
Therapeutics:antidiabetic

Found: 3 active | as graph: single | with analogs << Back 1 2 3
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.2875±0.0046669
Normalized OD Score: sc h 0.7614±0.0123112
Z-Score: -6.6745±0.353192
p-Value: 0.0000000000682468
Z-Factor: 0.377404
Fitness Defect: 23.4079
Bioactivity Statement: Toxic
Experimental Conditions
Library:Spectrum
Plate Number and Position:20|E3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.20 Celcius
Date:2006-02-22 YYYY-MM-DD
Plate CH Control (+):0.040625±0.00121
Plate DMSO Control (-):0.35514999999999997±0.01336
Plate Z-Factor:0.8763
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DBLink | Rows returned: 2
77999 5-[[4-[2-(methyl-pyridin-2-yl-amino)ethoxy]phenyl]methyl]thiazolidine-2,4-dione
445655 (5S)-5-[[4-[2-(methyl-pyridin-2-yl-amino)ethoxy]phenyl]methyl]thiazolidine-2,4-dione

internal high similarity DBLink | Rows returned: 0

active | Cluster 7138 | Additional Members: 4 | Rows returned: 0

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