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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: 173 nonactive | as graph: single | with analogs [1] << Back 131 132 133 134 135 136 137 138 139 140  Next >> [173]
Species: 4932
Condition: MT2481-pdr1pdr3-2nd
Replicates: 2
Raw OD Value: r im 0.6121±0.00113137
Normalized OD Score: sc h 0.9940±0.00463721
Z-Score: -1.4107±0.27483
p-Value: 0.166169
Z-Factor: -9.79458
Fitness Defect: 1.7947
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:25|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.40 Celcius
Date:2008-08-22 YYYY-MM-DD
Plate CH Control (+):0.04035±0.00078
Plate DMSO Control (-):0.588225±0.01262
Plate Z-Factor:0.9324
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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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