Compound Information | SONAR Target prediction | Name: | CARYOPHYLLENE [t(-)] | Unique Identifier: | SPE01500842 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 168.15 g/mol | X log p: | 3.322 (online calculus) | Lipinksi Failures | 0 | TPSA | 0 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 0 | Rotatable Bond Count: | 0 | Canonical Smiles: | CC1CCC2C(CC2(C)C)C(=C)CC=1 | Class: | sesquiterpene | Source: | clove, cinnamon and many other oils |
Species: |
4932 |
Condition: |
TRK1 |
Replicates: |
2 |
Raw OD Value: r im |
0.4100±0.00183848 |
Normalized OD Score: sc h |
0.8358±0.00762066 |
Z-Score: |
-5.0695±0.212179 |
p-Value: |
0.000000523522 |
Z-Factor: |
0.321919 |
Fitness Defect: |
14.4627 |
Bioactivity Statement: |
Active |
Experimental Conditions | | Library: | SPECMTS3 | Plate Number and Position: | 22|A2 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.80 Celcius | Date: | 2008-03-14 YYYY-MM-DD | Plate CH Control (+): | 0.039925±0.00066 | Plate DMSO Control (-): | 0.4719±0.01287 | Plate Z-Factor: | 0.9033 |
| png ps pdf |
6708700 |
(1R,8S)-4,10,10-trimethyl-7-methylidene-bicyclo[6.2.0]dec-4-ene |
internal high similarity DBLink | Rows returned: 0 | |
active | Cluster 8140 | Additional Members: 2 | Rows returned: 0 | |
|