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Compound InformationSONAR Target prediction
Name:

DEHYDROABIETAMIDE

Unique Identifier:SPE00307050
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:270.22 g/mol
X log p:6.033  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:2
Canonical Smiles:CC(C)c1ccc2c(CCC3C(C)(CCCC32C)C(N)=O)c1
Class:diterpene
Source:derivative

Found: 56 active | as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [56]
Species: 4932
Condition: SPE01500325
Replicates: 2
Raw OD Value: r im 0.0879±0
Normalized OD Score: sc h 0.3779±0
Z-Score: -5.5115±0
p-Value: 0.0000000355772
Z-Factor: 0.442642
Fitness Defect: 17.1516
Bioactivity Statement: Toxic
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|F8
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:0.00 Celcius
Date:2006-08-13 YYYY-MM-DD
Plate CH Control (+):0.0388±0.00084
Plate DMSO Control (-):0.2326±0.02729
Plate Z-Factor:0.5688
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DBLink | Rows returned: 1
3983547 1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide

internal high similarity DBLink | Rows returned: 0

active | Cluster 7722 | Additional Members: 4 | Rows returned: 1
SPE01504234 0.352112676056338

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