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Compound InformationSONAR Target prediction
Name:

PRENYLETIN

Unique Identifier:SPE00100101
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:232.147 g/mol
X log p:10.873  (online calculus)
Lipinksi Failures1
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:CC(C)=CCOc1cc2OC(=O)C=Cc2cc1O
Class:coumarin
Source:Ptaeroxylon obliquum
Reference:J Chem Soc (C) 1967:145; Tet Lett 1967:2147

Found: 50 active | as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [50]
Species: 4932
Condition: SPE01502260
Replicates: 2
Raw OD Value: r im 0.2251±0
Normalized OD Score: sc h 0.6625±0
Z-Score: -5.4674±0
p-Value: 0.0000000456572
Z-Factor: 0.612214
Fitness Defect: 16.9021
Bioactivity Statement: Active
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|A5
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:0.00 Celcius
Date:2006-08-13 YYYY-MM-DD
Plate CH Control (+):0.04065±0.00109
Plate DMSO Control (-):0.33975±0.01459
Plate Z-Factor:0.8418
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DBLink | Rows returned: 1
3873459 6-hydroxy-7-(3-methylbut-2-enoxy)chromen-2-one

internal high similarity DBLink | Rows returned: 0

active | Cluster 14605 | Additional Members: 7 | Rows returned: 1
SPE01504168 0.573770491803279

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