Compound Information | SONAR Target prediction | Name: | Chaulmoogric Acid, Ethyl Ester | Unique Identifier: | LAT001B07 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C20H36O2 | 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 |
Species: |
4932 |
Condition: |
pdr18h |
Replicates: |
2 |
Raw OD Value: r im |
0.6808±0.0205061 |
Normalized OD Score: sc h |
1.0955±0.0162959 |
Z-Score: |
2.8574±0.67095 |
p-Value: |
0.00901792 |
Z-Factor: |
-3.86954 |
Fitness Defect: |
4.7085 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | LATCA | Plate Number and Position: | 1|B7 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 24.90 Celcius | Date: | 2007-03-08 YYYY-MM-DD | Plate CH Control (+): | 0.040175±0.00183 | Plate DMSO Control (-): | 0.629975±0.20881 | Plate Z-Factor: | -0.0737 |
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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 | |
nonactive | Cluster 3231 | Additional Members: 3 | Rows returned: 2 | |
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