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Compound InformationSONAR Target prediction
Name:

12a-HYDROXY-5-DEOXYDEHYDROMUNDUSERONE

Unique Identifier:SPE00202175
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:324.2 g/mol
X log p:13.364  (online calculus)
Lipinksi Failures1
TPSA46.15
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:3
Canonical Smiles:COc1ccc2C=C3c4cc(OC)c(OC)cc4OCC3(O)Oc2c1
Class:rotenoid
Source:derivative

Found: 12 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 10  Next >> 
Species: 4932
Condition: SPE01500325
Replicates: 2
Raw OD Value: r im 0.0895±0
Normalized OD Score: sc h 0.1355±0
Z-Score: -26.0530±0
p-Value: 0
Z-Factor: 0.845308
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|C9
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:0.00 Celcius
Date:2006-08-13 YYYY-MM-DD
Plate CH Control (+):0.03925±0.00061
Plate DMSO Control (-):0.6607±0.02910
Plate Z-Factor:0.8549
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DBLink | Rows returned: 1
4620898

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 1665 | Additional Members: 1 | Rows returned: 0
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