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Compound InformationSONAR Target prediction
Name:

EUGENITOL

Unique Identifier:SPE00200447
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:196.115 g/mol
X log p:4.311  (online calculus)
Lipinksi Failures0
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:CC1Oc2cc(O)c(C)c(O)c2C(=O)C=1
Class:chromone
Source:Eugenia caryophyllata
Reference:Helv Chim Acta 31: 1603 (1948)

Found: 191 nonactive | as graph: single | with analogs [1] << Back 171 172 173 174 175 176 177 178 179 180  Next >> [191]
Species: 4932
Condition: SWI4
Replicates: 2
Raw OD Value: r im 0.5912±0.00806102
Normalized OD Score: sc h 1.0292±0.0190187
Z-Score: 1.2866±0.824157
p-Value: 0.271538
Z-Factor: -3.71673
Fitness Defect: 1.3037
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|D9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.20 Celcius
Date:2008-02-07 YYYY-MM-DD
Plate CH Control (+):0.042249999999999996±0.00090
Plate DMSO Control (-):0.5550999999999999±0.01721
Plate Z-Factor:0.8932
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DBLink | Rows returned: 1
5036604 5,7-dihydroxy-2,6-dimethyl-chromen-4-one

internal high similarity DBLink | Rows returned: 4
JFD 00137 0.9009
SPE00100529 0.9250
SPE00200449 0.9646
SPE00100528 0.9823

active | Cluster 4376 | Additional Members: 4 | Rows returned: 2
SPE00100513 0.419354838709677
SPE00100719 0

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