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Compound InformationSONAR Target prediction
Name:

DAIDZEIN

Unique Identifier:SPE00200789
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:244.158 g/mol
X log p:16.755  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Oc1ccc(cc1)C1=COc2cc(O)ccc2C1=O
Class:isoflavone
Source:red clover
Reference:J Chem Soc 1933: 274
Therapeutics:phytoestrogen

Found: 205 nonactive as graph: single | with analogs [1] << Back 201 202 203 204 205 Next >> [205]
Species: 4932
Condition: VPS35
Replicates: 2
Raw OD Value: r im 0.6882±0.0000707107
Normalized OD Score: sc h 0.9864±0.00312342
Z-Score: -0.6885±0.169828
p-Value: 0.494238
Z-Factor: -8.34269
Fitness Defect: 0.7047
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|F9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2008-02-20 YYYY-MM-DD
Plate CH Control (+):0.041874999999999996±0.00033
Plate DMSO Control (-):0.6765249999999999±0.01775
Plate Z-Factor:0.9139
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DBLink | Rows returned: 1
5281708 7-hydroxy-3-(4-hydroxyphenyl)chromen-4-one

internal high similarity DBLink | Rows returned: 161 2 3 Next >> 
SPE00201355 0.9070
SPE00240645 0.9141
SPE00201310 0.9286
SPE00201309 0.9435
BTB 12551 0.9492
SPE01500726 0.9669

active | Cluster 8155 | Additional Members: 16 | Rows returned: 3
SPE00200422 0.396551724137931
SPE00201187 0.296296296296296
SPE00102007 0

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