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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 71 72 73 74 75 76 77 78 79 80  Next >> [104]
Species: 4932
Condition: SPT3
Replicates: 2
Raw OD Value: r im 0.5636±0.0220617
Normalized OD Score: sc h 0.9582±0.024955
Z-Score: -0.2264±0.514612
p-Value: 0.72282
Z-Factor: -3.50826
Fitness Defect: 0.3246
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:1|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2008-02-13 YYYY-MM-DD
Plate CH Control (+):0.04135±0.00108
Plate DMSO Control (-):0.5620499999999999±0.01815
Plate Z-Factor:0.8849
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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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