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Compound InformationSONAR Target prediction
Name:

2-,4-DIHYDROXY-3,4-,6--TRIMETHOXYCHALCONE

Unique Identifier:SPE01505140
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18H18O6
Molecular Weight:312.189 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1cc(O)c(C(=O)C=Cc2ccc(O)c(OC)c2)c(OC)c1
Class:chalcone
Source:Viscum album (glucoside)
Reference:Annalen 550:146 (1942); Planta 95:133 (1970); Phytochemistry 13:1561 (1974)

Found: 9 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 Next >> 
Species: 4932
Condition: GIM4
Replicates: 2
Raw OD Value: r im 0.6113±0.000212132
Normalized OD Score: sc h 0.8202±0.00251122
Z-Score: -8.3535±0.219933
p-Value: 1.30993e-16
Z-Factor: 0.621958
Fitness Defect: 36.5714
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|A6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2008-03-20 YYYY-MM-DD
Plate CH Control (+):0.040374999999999994±0.00137
Plate DMSO Control (-):0.721575±0.01435
Plate Z-Factor:0.9304
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 10748 | Additional Members: 6 | Rows returned: 3
SPE01505345 0.352941176470588
SPE01501017 0
LAT005C02 0

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