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Compound InformationSONAR Target prediction
Name:

QUERCETIN TETRAMETHYL (5,7,3-,4-) ETHER

Unique Identifier:SPE00300538
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:340.199 g/mol
X log p:12.502  (online calculus)
Lipinksi Failures1
TPSA63.22
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:5
Canonical Smiles:COc1cc(OC)c2C(=O)C(O)=C(Oc2c1)c1ccc(OC)c(OC)c1
Class:flavone
Source:Sterculia foetida

Found: 131 active | as graph: single | with analogs [1] << Back 111 112 113 114 115 116 117 118 119 120  Next >> [131]
Species: 4932
Condition: SNC1
Replicates: 2
Raw OD Value: r im 0.6465±0.0122329
Normalized OD Score: sc h 0.9042±0.0198155
Z-Score: -5.4279±0.984161
p-Value: 0.00000111186
Z-Factor: -0.0570674
Fitness Defect: 13.7095
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:10|F6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2008-04-24 YYYY-MM-DD
Plate CH Control (+):0.0409±0.00076
Plate DMSO Control (-):0.70295±0.00939
Plate Z-Factor:0.9490
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DBLink | Rows returned: 1
97142 2-(3,4-dimethoxyphenyl)-3-hydroxy-5,7-dimethoxy-chromen-4-one

internal high similarity DBLink | Rows returned: 92 Next >> 
SPE01600075 0.9305
SPE01502247 0.9310
LOPAC 01061 0.9425
LOPAC 01176 0.9425
SPE01500672 0.9425
SPE01504065 0.9425

nonactive | Cluster 6267 | Additional Members: 3 | Rows returned: 1
SPE00310031 0

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