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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 1 2 3 4 5 6 7 8 9 10  Next >> [205]
Species: 4932
Condition: ATP4
Replicates: 2
Raw OD Value: r im 0.6576±0.0110309
Normalized OD Score: sc h 1.0258±0.0104569
Z-Score: 0.9464±0.330568
p-Value: 0.357018
Z-Factor: -3.88082
Fitness Defect: 1.03
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:4|B5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.40 Celcius
Date:2008-03-06 YYYY-MM-DD
Plate CH Control (+):0.03985±0.00060
Plate DMSO Control (-):0.61985±0.02294
Plate Z-Factor:0.9001
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

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

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