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Compound InformationSONAR Target prediction
Name:

METHYLMETHANE SULFONATE

Unique Identifier:SPE00330003
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:104.086 g/mol
X log p:-1.365  (online calculus)
Lipinksi Failures0
TPSA51.75
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:COS(C)(=O)=O
Source:synthetic
Therapeutics:alkylating agent

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: ABP1
Replicates: 2
Raw OD Value: r im 0.6938±0.00275772
Normalized OD Score: sc h 0.9930±0.000188612
Z-Score: -0.3657±0.0230066
p-Value: 0.714596
Z-Factor: -7.08013
Fitness Defect: 0.336
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|F6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.80 Celcius
Date:2007-12-20 YYYY-MM-DD
Plate CH Control (+):0.041499999999999995±0.00038
Plate DMSO Control (-):0.6709499999999999±0.01539
Plate Z-Factor:0.9249
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DBLink | Rows returned: 1
4156 methylsulfonyloxymethane

internal high similarity DBLink | Rows returned: 0

active | Cluster 6784 | Additional Members: 1 | Rows returned: 0
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