Compound Information | SONAR Target prediction | Name: | DIHYDRO-beta-TUBAIC ACID | Unique Identifier: | SPE00211531 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C13H16O4 | Molecular Weight: | 220.137 g/mol | X log p: | 3.884 (online calculus) | Lipinksi Failures | 0 | TPSA | 35.53 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 4 | Rotatable Bond Count: | 2 | Canonical Smiles: | COc1c2CCC(C)(C)Oc2ccc1C(O)=O | Source: | derivative ex mundulone |
Species: |
4932 |
Condition: |
SPE00300034 |
Replicates: |
2 |
Raw OD Value: r im |
0.4065±0.0399515 |
Normalized OD Score: sc h |
1.1886±0.0561172 |
Z-Score: |
0.9978±0.353945 |
p-Value: |
0.333386 |
Z-Factor: |
-6.0852 |
Fitness Defect: |
1.0985 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | SpectrumTMP | Plate Number and Position: | 1|E5 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 22.30 Celcius | Date: | 2006-12-21 YYYY-MM-DD | Plate CH Control (+): | 0.040475±0.00248 | Plate DMSO Control (-): | 0.43525±0.07325 | Plate Z-Factor: | 0.5082 |
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DBLink | Rows returned: 1 | |
3548249 |
5-methoxy-2,2-dimethyl-chroman-6-carboxylic acid |
internal high similarity DBLink | Rows returned: 0 | |
active | Cluster 8617 | Additional Members: 1 | Rows returned: 0 | |
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