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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: 573 nonactive | as graph: single | with analogs [1] << Back 541 542 543 544 545 546 547 548 549 550  Next >> [573]
Species: 4932
Condition: SNC1
Replicates: 2
Raw OD Value: r im 0.6975±0.00487904
Normalized OD Score: sc h 0.9664±0.00569541
Z-Score: -1.9116±0.275057
p-Value: 0.0605742
Z-Factor: -1.46819
Fitness Defect: 2.8039
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|G6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2008-04-24 YYYY-MM-DD
Plate CH Control (+):0.041249999999999995±0.00321
Plate DMSO Control (-):0.6973749999999999±0.01468
Plate Z-Factor:0.9349
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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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