Compound Information | SONAR Target prediction | Name: | CHAULMOOGRIC ACID, ETHYL ESTER | Unique Identifier: | SPE00310017 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 272.213 g/mol | X log p: | 4.413 (online calculus) | Lipinksi Failures | 1 | TPSA | 26.3 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 2 | Rotatable Bond Count: | 15 | Canonical Smiles: | CCOC(=O)CCCCCCCCCCCCC1CCC=C1 | Source: | semisynthetic | Therapeutics: | antilepretic |
Species: |
4932 |
Condition: |
DEP1 |
Replicates: |
2 |
Raw OD Value: r im |
0.0385±0.000565685 |
Normalized OD Score: sc h |
0.0540±0.000383854 |
Z-Score: |
-42.3631±4.15161 |
p-Value: |
0 |
Z-Factor: |
0.956472 |
Fitness Defect: |
INF |
Bioactivity Statement: |
Toxic |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 10|C3 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.40 Celcius | Date: | 2005-12-22 YYYY-MM-DD | Plate CH Control (+): | 0.038775000000000004±0.00092 | Plate DMSO Control (-): | 0.692075±0.00923 | Plate Z-Factor: | 0.9600 |
| png ps pdf |
556575 |
ethyl 2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylate |
4176524 |
ethyl 13-(1-cyclopentenyl)tridecanoate |
5176736 |
ethyl octadec-6-enoate |
5352859 |
propan-2-yl (E)-hexadec-9-enoate |
5356108 |
propan-2-yl (E)-octadec-9-enoate |
5363269 |
ethyl (E)-octadec-9-enoate |
internal high similarity DBLink | Rows returned: 1 | |
active | Cluster 3231 | Additional Members: 3 | Rows returned: 1 | |
|