Home | Screening data | Screen comparisons | Search for compounds | Structure search

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 361 362 363 364 365
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.4438±0.0019799
Normalized OD Score: sc h 0.8230±0.00481588
Z-Score: -4.9528±0.127497
p-Value: 0.000000808402
Z-Factor: 0.265375
Fitness Defect: 14.0282
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|G4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2008-06-05 YYYY-MM-DD
Plate CH Control (+):0.041374999999999995±0.00097
Plate DMSO Control (-):0.530275±0.01952
Plate Z-Factor:0.8688
png
ps
pdf

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

Service provided by the Mike Tyers Laboratory