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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: SSE1
Replicates: 2
Raw OD Value: r im 0.4473±0.000494975
Normalized OD Score: sc h 1.0289±0.015169
Z-Score: 0.7839±0.449038
p-Value: 0.455846
Z-Factor: -4.53977
Fitness Defect: 0.7856
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:1|C11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.20 Celcius
Date:2008-05-01 YYYY-MM-DD
Plate CH Control (+):0.040975±0.00057
Plate DMSO Control (-):0.404525±0.02103
Plate Z-Factor:0.8491
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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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