| Compound Information | SONAR Target prediction | | Name: | DIHYDROJASMONIC ACID | | Unique Identifier: | SPE01504104 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 192.127 g/mol | | X log p: | -1.077 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 34.14 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 6 | | Canonical Smiles: | CCCCCC1C(CCC1=O)CC(O)=O | | Class: | alkane | | Source: | Jasminium spp and Vicia faba | | Reference: | Helv Chim Acta 57: 1301 (1974); Tet Lett 3413 (1974); JACS 97: 6144 (1975); PNAS 98:
4788 (2001) | | Therapeutics: | plant growth regulator |
| Species: |
4932 |
| Condition: |
TRK1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.4784±0.0148492 |
| Normalized OD Score: sc h |
0.9613±0.00908927 |
| Z-Score: |
-1.1985±0.283129 |
| p-Value: |
0.24003 |
| Z-Factor: |
-3.19203 |
| Fitness Defect: |
1.427 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 16|G10 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.80 Celcius | | Date: | 2008-03-14 YYYY-MM-DD | | Plate CH Control (+): | 0.040925±0.00154 | | Plate DMSO Control (-): | 0.468175±0.02185 | | Plate Z-Factor: | 0.8104 |
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| 102966 |
3-(2-oxocyclopentyl)propanoic acid |
| 107126 |
2-(3-oxo-2-pentyl-cyclopentyl)acetic acid |
| 185900 |
2-ethyl-5-oxo-hexanoic acid |
| 192730 |
4-oxocyclohexane-1-carboxylic acid |
| 192880 |
3-[(3aS,4S,7aS)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1H-inden-4-yl]propanoic acid |
| 223275 |
3,3,5,5-tetrakis(2-carboxyethyl)-4-oxo-cyclohexane-1-carboxylic acid |
| internal high similarity DBLink | Rows returned: 13 | 1 2 3 Next >> |
| active | Cluster 11884 | Additional Members: 2 | Rows returned: 1 | |
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