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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 2 3 Next >> 
Species: 4932
Condition: RGP1
Replicates: 2
Raw OD Value: r im 0.3314±0.0108187
Normalized OD Score: sc h 0.7573±0.0229351
Z-Score: -6.3422±0.684264
p-Value: 0.0000000023422
Z-Factor: 0.314337
Fitness Defect: 19.8722
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:5|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2008-06-26 YYYY-MM-DD
Plate CH Control (+):0.04±0.00048
Plate DMSO Control (-):0.4274±0.01390
Plate Z-Factor:0.8823
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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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