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Compound InformationSONAR Target prediction
Name:

CHOLESTANONE

Unique Identifier:SPE01500852
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C27H46O
Molecular Weight:341.296 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC(C)CCCC(C)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C
Class:sterol
Source:mammalian tissue
Reference:Biochem J 40:79 (1946)

Found: 91 nonactive as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [91]
Species: 4932
Condition: SWC5
Replicates: 2
Raw OD Value: r im 0.6595±0.00940452
Normalized OD Score: sc h 1.0081±0.00320339
Z-Score: 0.3745±0.164438
p-Value: 0.70992
Z-Factor: -14.2607
Fitness Defect: 0.3426
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:22|A6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.00 Celcius
Date:2008-06-19 YYYY-MM-DD
Plate CH Control (+):0.039749999999999994±0.00047
Plate DMSO Control (-):0.6352±0.01993
Plate Z-Factor:0.9137
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 5819 | Additional Members: 6 | Rows returned: 0
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