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Compound InformationSONAR Target prediction
Name:

AVOCATIN A

Unique Identifier:SPE00210025
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:584.402 g/mol
X log p:1.085  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:17
Canonical Smiles:CC(=O)OCC(O)CC(O)CCCCCCCCCCCC=C.CC(=O)OCC(O)CC(O)CCCCCCCCCCCC#C
Class:lipid
Source:Persea spp
Reference:An Acad Brasil Cienc 42 (suplemento): 45 (1970)
Therapeutics:antibacterial, antifungal

Found: 365 active | as graph: single | with analogs [1] << Back 351 352 353 354 355 356 357 358 359 360  Next >> [365]
Species: 4932
Condition: HXK2
Replicates: 2
Raw OD Value: r im 0.6394±0.00381838
Normalized OD Score: sc h 0.8465±0.00510344
Z-Score: -6.8408±0.369317
p-Value: 0.0000000000241954
Z-Factor: 0.580649
Fitness Defect: 24.4449
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|G4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.90 Celcius
Date:2008-03-05 YYYY-MM-DD
Plate CH Control (+):0.04165±0.00068
Plate DMSO Control (-):0.731475±0.01199
Plate Z-Factor:0.9314
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DBLink | Rows returned: 1
6710728 2,4-dihydroxyheptadec-16-enyl acetate; 2,4-dihydroxyheptadec-16-ynyl acetate

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 289 | Additional Members: 6 | Rows returned: 3
SPE01505234 0.439024390243902
SPE00211552 0
SPE00240932 0

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