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Compound InformationSONAR Target prediction
Name:

4,6-DIMETHOXY-5-METHYLISOFLAVONE

Unique Identifier:SPE00211076
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:280.19 g/mol
X log p:15.438  (online calculus)
Lipinksi Failures1
TPSA44.76
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:COc1cc2OC=C(C(=O)c2c(OC)c1C)c1ccccc1
Source:analog

Found: 23 active | as graph: single | with analogs [1] << Back 21 22 23 Next >> [23]
Species: 4932
Condition: SPT3
Replicates: 2
Raw OD Value: r im 0.4104±0.102389
Normalized OD Score: sc h 0.7066±0.126332
Z-Score: -4.5171±1.95992
p-Value: 0.000870264
Z-Factor: -0.65749
Fitness Defect: 7.0467
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:25|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.50 Celcius
Date:2008-02-13 YYYY-MM-DD
Plate CH Control (+):0.041675000000000004±0.00040
Plate DMSO Control (-):0.5444500000000001±0.02008
Plate Z-Factor:0.8322
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DBLink | Rows returned: 1
6710721 5,7-dimethoxy-6-methyl-3-phenyl-chromen-4-one

internal high similarity DBLink | Rows returned: 92 Next >> 
LOPAC 00433 0.9008
SPE00201187 0.9008
SPE00210296 0.9008
BTB 12549 0.9077
SPE00240565 0.9077
SPE10100003 0.9084

active | Cluster 9315 | Additional Members: 4 | Rows returned: 1
SPE00200763 0

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