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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] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [50]
Species: 4932
Condition: SER1
Replicates: 2
Raw OD Value: r im 0.4493±0.0576999
Normalized OD Score: sc h 0.7201±0.0756274
Z-Score: -8.8534±2.62528
p-Value: 0.00000000000130747
Z-Factor: -1.86873
Fitness Defect: 27.3629
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:1|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2007-09-17 YYYY-MM-DD
Plate CH Control (+):0.04035±0.00082
Plate DMSO Control (-):0.603675±0.09827
Plate Z-Factor:0.4593
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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

nonactive | Cluster 14605 | Additional Members: 7 | Rows returned: 3
SPE01504168 0.573770491803279
SPE01502242 0
Prest1125 0

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