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Compound InformationSONAR Target prediction
Name:

ALLOPURINOL

Unique Identifier:SPE01500108
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:132.08 g/mol
X log p:3.587  (online calculus)
Lipinksi Failures0
TPSA41.79
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:0
Canonical Smiles:O=C1NC=Nc2nncc12
Source:synthetic
Therapeutics:antihyperuricemia, antigout, antiurolithic

Found: 205 nonactive as graph: single | with analogs [1] << Back 171 172 173 174 175 176 177 178 179 180  Next >> [205]
Species: 4932
Condition: SMI1
Replicates: 2
Raw OD Value: r im 0.6504±0.0120208
Normalized OD Score: sc h 1.0004±0.00323358
Z-Score: 0.0060±0.0674323
p-Value: 0.96197
Z-Factor: -16.648
Fitness Defect: 0.0388
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|D5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.60 Celcius
Date:2005-12-20 YYYY-MM-DD
Plate CH Control (+):0.03875000000000001±0.00246
Plate DMSO Control (-):0.6314±0.01665
Plate Z-Factor:0.9302
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 1079 | Additional Members: 1 | Rows returned: 0

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