| Compound Information | SONAR Target prediction | | Name: | SELAMECTIN | | Unique Identifier: | SPE01503720 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 676.454 g/mol | | X log p: | 8.983 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 81.68 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 10 | | Rotatable Bond Count: | 4 | | Canonical Smiles: | COC1CC(OC(C)C1O)OC1C(C)C=CC=C2COC3CC(C)=CC(C(=O)OC4CC(CC=C1C)OC1(CCC(C
)C(O1)C1CCCCC1)C4)C32O | | Source: | semisynthetic | | Therapeutics: | antiparasitic, antimite |
| Species: |
4932 |
| Condition: |
SUR2 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7652±0.0146371 |
| Normalized OD Score: sc h |
1.0227±0.00952085 |
| Z-Score: |
1.1394±0.461504 |
| p-Value: |
0.27947 |
| Z-Factor: |
-2.67528 |
| Fitness Defect: |
1.2749 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 20|D8 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 23.90 Celcius | | Date: | 2008-05-06 YYYY-MM-DD | | Plate CH Control (+): | 0.040975±0.00045 | | Plate DMSO Control (-): | 0.7245999999999999±0.01430 | | Plate Z-Factor: | 0.9279 |
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| DBLink | Rows returned: 3 | |
| internal high similarity DBLink | Rows returned: 2 | |
| active | Cluster 12611 | Additional Members: 6 | Rows returned: 2 | |
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