| Compound Information | SONAR Target prediction | | Name: | MUNDULONE | | Unique Identifier: | SPE00200011 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C26H26O6 | | Molecular Weight: | 408.275 g/mol | | X log p: | (online calculus) | | Lipinksi Failures | | | TPSA | | | Hydrogen Bond Donor Count: | | | Hydrogen Bond Acceptors Count: | | | Rotatable Bond Count: | | | Canonical Smiles: | COc1c2C=CC(C)(C)Oc2ccc1C1=COc2cc3OC(C)(C)C(O)Cc3cc2C1=O | | Class: | isoflavone | | Source: | Mundulea sericea | | Reference: | Tet Letters 1963, 281 |
| Species: |
4932 |
| Condition: |
LAT1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6506±0.00254558 |
| Normalized OD Score: sc h |
0.9749±0.00127237 |
| Z-Score: |
-1.2345±0.0151615 |
| p-Value: |
0.217044 |
| Z-Factor: |
-2.68558 |
| Fitness Defect: |
1.5277 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 10|A3 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 27.40 Celcius | | Date: | 2008-04-23 YYYY-MM-DD | | Plate CH Control (+): | 0.039925±0.00038 | | Plate DMSO Control (-): | 0.6471750000000001±0.01884 | | Plate Z-Factor: | 0.9075 |
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| DBLink | Rows returned: 0 | |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 2161 | Additional Members: 6 | Rows returned: 2 | |
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