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Compound InformationSONAR Target prediction
Name:

15-NORCARYOPHYLLEN-3-ONE

Unique Identifier:SPE00300166
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14H22O
Molecular Weight:184.149 g/mol
X log p:2.29  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:0
Canonical Smiles:CC1CCC2C(CC2(C)C)C(=O)CCC=1
Source:derivative

Found: 114 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [114]
Species: 4932
Condition: BY4741-3rd
Replicates: 2
Raw OD Value: r im 0.6536±0.0103945
Normalized OD Score: sc h 1.0073±0.00721443
Z-Score: 0.9919±0.238546
p-Value: 0.328112
Z-Factor: -3.44676
Fitness Defect: 1.1144
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:3|C8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.20 Celcius
Date:2007-09-25 YYYY-MM-DD
Plate CH Control (+):0.039575±0.00076
Plate DMSO Control (-):0.643175±0.02819
Plate Z-Factor:0.8611
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DBLink | Rows returned: 78<< Back 11 12 13
6993841 (1S,5R)-bicyclo[3.2.0]hept-3-en-7-one
7057322 (1S,5S)-bicyclo[3.2.1]oct-6-en-3-one
7057323 (1R,5R)-bicyclo[3.2.1]oct-6-en-3-one
7472015 (1S,5S)-bicyclo[3.2.0]hept-3-en-7-one
7472016 (1R,5R)-bicyclo[3.2.0]hept-3-en-7-one
11075295 n/a

internal high similarity DBLink | Rows returned: 4
SPE01800109 0.9167
NRB 03735 0.9429
NRB 03822 0.9429
JFD 02026 0.9459

active | Cluster 8140 | Additional Members: 2 | Rows returned: 1
SPE01500842 0

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