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Compound InformationSONAR Target prediction
Name:

ERIODYCTOL

Unique Identifier:SPE01505145
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H12O6
Molecular Weight:276.157 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(O)c(O)c1
Class:flavan
Source:common flavan in numerous plant families
Reference:J Chem Soc 91:895 (1907); 97:2054 (1910)
Therapeutics:expectorant

Found: 91 nonactive as graph: single | with analogs [1] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [91]
Species: 4932
Condition: GYP1
Replicates: 2
Raw OD Value: r im 0.7069±0.00586899
Normalized OD Score: sc h 0.9922±0.00728598
Z-Score: -0.4323±0.406011
p-Value: 0.678238
Z-Factor: -8.17239
Fitness Defect: 0.3883
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:6|E3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.70 Celcius
Date:2008-06-10 YYYY-MM-DD
Plate CH Control (+):0.041499999999999995±0.00062
Plate DMSO Control (-):0.7008000000000001±0.01672
Plate Z-Factor:0.9243
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 14672 | Additional Members: 12 | Rows returned: 5
SPE01504154 0.416666666666667
SPE01500746 0.389830508474576
Prest531 0.389830508474576
SPE00310012 0
Prest908 0

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