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Compound InformationSONAR Target prediction
Name:

AVOCATIN B

Unique Identifier:SPE00211552
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C34H66O6
Molecular Weight:504.36 g/mol
X log p:0.612  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:15
Canonical Smiles:OCC(O)CC(O)CCCCCCCCCCCC=C.OCC(O)CC(O)CCCCCCCCCCCC#C
Source:Persea spp
Reference:An Acad Brasil Cienc 42 (suplemento): 45 (1970)

Found: 99 active | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [99]
Species: 4932
Condition: BY4741-3rd
Replicates: 2
Raw OD Value: r im 0.2277±0.0470226
Normalized OD Score: sc h 0.3370±0.0612025
Z-Score: -26.6031±1.08368
p-Value: 0
Z-Factor: -0.320314
Fitness Defect: INF
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:4|F10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2007-09-25 YYYY-MM-DD
Plate CH Control (+):0.039625±0.00079
Plate DMSO Control (-):0.659925±0.13285
Plate Z-Factor:0.2757
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DBLink | Rows returned: 1
6710748 heptadec-16-ene-1,2,4-triol; heptadec-16-yne-1,2,4-triol

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 289 | Additional Members: 6 | Rows returned: 3
SPE01505234 0.439024390243902
SPE00210025 0.416666666666667
SPE00240932 0

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