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Compound InformationSONAR Target prediction
Name:

FLAVANONE

Unique Identifier:SPE00200343
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H12O2
Molecular Weight:212.159 g/mol
X log p:18.752  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:1
Canonical Smiles:O=C1CC(Oc2ccccc12)c1ccccc1
Source:synthetic analog

Found: 101 nonactive as graph: single | with analogs [1] << Back 91 92 93 94 95 96 97 98 99 100  Next >> [101]
Species: 4932
Condition: TUB3
Replicates: 2
Raw OD Value: r im 0.6489±0.00410122
Normalized OD Score: sc h 0.9497±0.0037667
Z-Score: -3.0016±0.292359
p-Value: 0.0032633
Z-Factor: -1.38779
Fitness Defect: 5.725
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:5|E7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2007-10-12 YYYY-MM-DD
Plate CH Control (+):0.040575±0.00158
Plate DMSO Control (-):0.676275±0.02349
Plate Z-Factor:0.8740
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DBLink | Rows returned: 3
10251 2-phenylchroman-4-one
439652 (2S)-2-phenylchroman-4-one
689010 (2R)-2-phenylchroman-4-one

internal high similarity DBLink | Rows returned: 141 2 3 Next >> 
SPE01600561 0.9024
SPE01500746 0.9098
NRB 00919 0.9174
JFD 00169 0.9174
JFD 02323 0.9250
SPE01504154 0.9250

nonactive | Cluster 10088 | Additional Members: 12 | Rows returned: 1
SPE01500908 0.288888888888889

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