| Compound Information | SONAR Target prediction | | Name: | Bucladesine sodium salt | | Unique Identifier: | Prest32 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C18H25N5NaO9P | | Molecular Weight: | 486.2 g/mol | | X log p: | 2.324 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 161.32 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 13 | | Rotatable Bond Count: | 9 | | Canonical Smiles: | O.[Na+].[O-]P1(=O)OCC2C(OC(C2OC(=O)CCC)n2cnc3c(NC(=O)CCC)ncnc23)O1 |
| Species: |
9606 |
| Condition: |
TMPPre001 |
| Replicates: |
2 |
| Raw OD Value: r im |
1040.0000±0 |
| Normalized OD Score: sc h |
0.9581±0 |
| Z-Score: |
-0.9436±0 |
| p-Value: |
0.345354 |
| Z-Factor: |
-9.64226 |
| Fitness Defect: |
1.0632 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Prestwick | | Plate Number and Position: | 11|B4 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 0 nm | | Robot Temperature: | 23.20 Celcius | | Date: | 2006-10-10 YYYY-MM-DD | | Plate CH Control (+): | 853.5±701.09504 | | Plate DMSO Control (-): | 849±311.18603 | | Plate Z-Factor: | -72.3031 |
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| DBLink | Rows returned: 0 | |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 11040 | Additional Members: 3 | Rows returned: 0 | |
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