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Compound InformationSONAR Target prediction
Name:

ASPARTAME

Unique Identifier:SPE01505306
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14H18N2O5
Molecular Weight:276.16 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COC(=O)C(Cc1ccccc1)NC(=O)C(N)CC(O)=O
Source:synthetic
Therapeutics:sweetener

Found: 104 nonactive as graph: single | with analogs [1] << Back 101 102 103 104
Species: 4932
Condition: TOR1
Replicates: 2
Raw OD Value: r im 0.9679±0.00997021
Normalized OD Score: sc h 0.9613±0.0160275
Z-Score: 0.1532±0.442041
p-Value: 0.757378
Z-Factor: -3.83412
Fitness Defect: 0.2779
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:9|F10
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0017000000000000001±0.00216
Plate DMSO Control (-):1.0085250000000001±0.03302
Plate Z-Factor:0.8818
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 10116 | Additional Members: 5 | Rows returned: 0
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