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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 1 2 3 4 5 6 7 8 9 10  Next >> [104]
Species: 4932
Condition: BEM2
Replicates: 2
Raw OD Value: r im 0.5004±0.00692965
Normalized OD Score: sc h 1.0266±0.00523461
Z-Score: 0.7841±0.166067
p-Value: 0.436126
Z-Factor: -3.01342
Fitness Defect: 0.8298
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:1|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.50 Celcius
Date:2008-02-05 YYYY-MM-DD
Plate CH Control (+):0.042025±0.00087
Plate DMSO Control (-):0.474525±0.01543
Plate Z-Factor:0.8992
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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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