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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 181 182 183 184 185 186 187 188 189 190  Next >> [201]
Species: 4932
Condition: SHM2
Replicates: 2
Raw OD Value: r im 0.7794±0.00325269
Normalized OD Score: sc h 1.0023±0.0028306
Z-Score: 0.0836±0.101713
p-Value: 0.933542
Z-Factor: -5.84404
Fitness Defect: 0.0688
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:22|D2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.80 Celcius
Date:2006-04-08 YYYY-MM-DD
Plate CH Control (+):0.0378±0.00181
Plate DMSO Control (-):0.76635±0.01488
Plate Z-Factor:0.9245
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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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