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Compound InformationSONAR Target prediction
Name:

KOPARIN

Unique Identifier:SPE00200422
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H12O6
Molecular Weight:288.168 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1ccc(c(O)c1O)C1=COc2cc(O)ccc2C1=O
Class:isoflavone
Source:Castanospermum australe
Reference:Aust J Chem 30:1827 (1977)

Found: 73 nonactive | as graph: single | with analogs [1] << Back 71 72 73 Next >> [73]
Species: 4932
Condition: pdr_yCG196
Replicates: 2
Raw OD Value: r im 0.7890±0.0353553
Normalized OD Score: sc h 1.0061±0.0269747
Z-Score: 0.2013±0.90062
p-Value: 0.532562
Z-Factor: -15.3974
Fitness Defect: 0.6301
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:15|E3
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09625±0.00629
Plate DMSO Control (-):0.9305000000000001±0.05108
Plate Z-Factor:0.6801
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 8155 | Additional Members: 16 | Rows returned: 2
SPE00201187 0.296296296296296
SPE00102007 0

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