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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 21 22 23 24 25 26 27 28 29 30  Next >> [205]
Species: 4932
Condition: GCN3
Replicates: 2
Raw OD Value: r im 0.7568±0.0970151
Normalized OD Score: sc h 1.0590±0.0598681
Z-Score: 2.9814±2.92914
p-Value: 0.181365
Z-Factor: -33.8556
Fitness Defect: 1.7072
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:4|B5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:21.10 Celcius
Date:2007-12-11 YYYY-MM-DD
Plate CH Control (+):0.042874999999999996±0.00227
Plate DMSO Control (-):0.70765±0.09650
Plate Z-Factor:0.3838
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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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