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Compound InformationSONAR Target prediction
Name:

Unique Identifier:SPE01505748
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:820.917 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CCC1=C(C)C2=Cc3n4[Mg]n5c(=CC1=N2)c(C)c1C(=O)C(C(=O)OC)C(C2=NC(=Cc4c(C)
c3C=C)C(C)C2CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)=c51

Found: 13 nonactive as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> 
Species: 4932
Condition: BCK1
Replicates: 2
Raw OD Value: r im 0.8290±0.066468
Normalized OD Score: sc h 0.9785±0.0259769
Z-Score: -0.7775±0.955958
p-Value: 0.532586
Z-Factor: -5.74236
Fitness Defect: 0.63
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:25|D5
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.0935±0.00480
Plate DMSO Control (-):0.9635±0.01616
Plate Z-Factor:0.9417
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