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Compound InformationSONAR Target prediction
Name:

4-Acetoxyphenol

Unique Identifier:LAT001D04
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8H8O3
Molecular Weight:144.084 g/mol
X log p:8.326  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:2
Canonical Smiles:CC(=O)Oc1ccc(O)cc1

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr24h
Replicates: 2
Raw OD Value: r im 0.7268±0.00127279
Normalized OD Score: sc h 1.0028±0.000396159
Z-Score: 0.2171±0.0312224
p-Value: 0.828198
Z-Factor: -8.07807
Fitness Defect: 0.1885
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:1|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040225±0.00178
Plate DMSO Control (-):0.6901999999999999±0.23283
Plate Z-Factor:-0.0802
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DBLink | Rows returned: 3
70987 (4-methoxyphenyl) acetate
71006 (4-acetyloxyphenyl) acetate
96009 (4-hydroxyphenyl) acetate

internal high similarity DBLink | Rows returned: 1
SPE00240740 1.0000

nonactive | Cluster 14842 | Additional Members: 6 | Rows returned: 2
SPE01504041 0.560975609756098
SPE00240740 0

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