| Compound Information | SONAR Target prediction | | Name: | ORSELLINIC ACID | | Unique Identifier: | SPE00300001 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 160.083 g/mol | | X log p: | 3.494 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 17.07 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 4 | | Rotatable Bond Count: | 1 | | Canonical Smiles: | Cc1cc(O)cc(O)c1C(O)=O | | Class: | aromatic | | Source: | common lichen constituent |
| Species: |
4932 |
| Condition: |
IDH2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.5631±0.0119501 |
| Normalized OD Score: sc h |
0.9914±0.0108545 |
| Z-Score: |
-0.4362±0.55443 |
| p-Value: |
0.686146 |
| Z-Factor: |
-19.7197 |
| Fitness Defect: |
0.3767 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 4|H9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 23.90 Celcius | | Date: | 2007-10-19 YYYY-MM-DD | | Plate CH Control (+): | 0.040625±0.00072 | | Plate DMSO Control (-): | 0.5622±0.04923 | | Plate Z-Factor: | 0.6809 |
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| DBLink | Rows returned: 2 | |
| 68072 |
2,4-dihydroxy-6-methyl-benzoic acid |
| 5460334 |
2,4-dihydroxy-6-methyl-benzoate |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 13178 | Additional Members: 8 | Rows returned: 3 | |
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