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

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 41 42 43 44 45 46 47 48 49 50 Next >> [50]
Species: 4932
Condition: SPT3
Replicates: 2
Raw OD Value: r im 0.3449±0.0363453
Normalized OD Score: sc h 0.7058±0.0358739
Z-Score: -4.5550±0.402449
p-Value: 0.0000104037
Z-Factor: 0.218543
Fitness Defect: 11.4733
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:14|H3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.90 Celcius
Date:2008-02-13 YYYY-MM-DD
Plate CH Control (+):0.040975±0.00162
Plate DMSO Control (-):0.46367500000000006±0.01906
Plate Z-Factor:0.8492
png
ps
pdf

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

Service provided by the Mike Tyers Laboratory