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Compound InformationSONAR Target prediction
Name:

AVOCADYNE

Unique Identifier:SPE01505234
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:252.18 g/mol
X log p:-1.131  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:14
Canonical Smiles:OCC(O)CC(O)CCCCCCCCCCCC#C
Class:lipid
Source:Persea spp
Reference:An Acad Brasil Cienc 42 (suplemento): 45 (1970); Tetrahedron 25:4617 (1969)
Therapeutics:antibacterial, antifungal

Found: 201 nonactive | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [201]
Species: 4932
Condition: DNM1
Replicates: 2
Raw OD Value: r im 0.6739±0.00961665
Normalized OD Score: sc h 0.9611±0.0143128
Z-Score: -1.5995±0.756892
p-Value: 0.159996
Z-Factor: -2.27554
Fitness Defect: 1.8326
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|G8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.10 Celcius
Date:2008-03-07 YYYY-MM-DD
Plate CH Control (+):0.041400000000000006±0.00060
Plate DMSO Control (-):0.682025±0.01756
Plate Z-Factor:0.9339
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DBLink | Rows returned: 1
3015189 heptadec-16-yne-1,2,4-triol

internal high similarity DBLink | Rows returned: 0

active | Cluster 289 | Additional Members: 6 | Rows returned: 5
LAT001B04 0.439024390243902
LAT001F03 0.416666666666667
SPE00210025 0.416666666666667
SPE00211552 0
SPE00240932 0

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