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Compound InformationSONAR Target prediction
Name:

PERILLYL ALCOHOL

Unique Identifier:SPE01505297
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H16O
Molecular Weight:136.106 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)C1CCC(CO)=CC1
Class:terpene
Source:Ocimum gratissimum
Reference:CR Hebd Seances Acad Sci 249:306 (1959); Cancer Res 57:420 (1997)
Therapeutics:antineoplastic, apoptosis inducer; skin irritant, LD50(rat) 2100 mg/kg po

Found: 2 active | as graph: single | with analogs << Back 1 2
Species: 4932
Condition: REF2
Replicates: 2
Raw OD Value: r im 0.3400±0.0197283
Normalized OD Score: sc h 0.8094±0.00642969
Z-Score: -5.4979±0.134117
p-Value: 0.000000043936
Z-Factor: 0.393705
Fitness Defect: 16.9405
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:16|A2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.50 Celcius
Date:2008-08-27 YYYY-MM-DD
Plate CH Control (+):0.04202499999999999±0.00088
Plate DMSO Control (-):0.3584±0.01168
Plate Z-Factor:0.8960
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 8846 | Additional Members: 5 | Rows returned: 1
SPE01502101 0

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