| Compound Information | SONAR Target prediction | | Name: | FUCOSTANOL | | Unique Identifier: | SPE01504053 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 364.31 g/mol | | X log p: | 1.79 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 6 | | Canonical Smiles: | CCC(CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C)C(C)C | | Class: | sterol | | Source: | Calendula officinalis | | Reference: | J Am Chem Soc 60: 2431 (1938) | | Generic_name: | 5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL | | Chemical_iupac_name: | 5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL | | Drug_type: | Experimental | | Drugbank_id: | EXPT00530 | | Logp: | 3.73 | | Drug_category: | Sex Hormone-Binding Globulin inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
BY4741-2nd |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8158±0.0257387 |
| Normalized OD Score: sc h |
0.9895±0.00909832 |
| Z-Score: |
0.3178±0.37132 |
| p-Value: |
0.75881 |
| Z-Factor: |
-6.58428 |
| Fitness Defect: |
0.276 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 8|C2 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 26.90 Celcius | | Date: | 2006-04-05 YYYY-MM-DD | | Plate CH Control (+): | 0.038275±0.00138 | | Plate DMSO Control (-): | 0.797325±0.01384 | | Plate Z-Factor: | 0.9423 |
|  png
ps
pdf |
| 7567270 |
(3R,4R)-3-methyldecan-4-ol |
| 7567326 |
(4S,5S)-4-methyldecan-5-ol |
| 7567331 |
(4S,5R)-4-methyldecan-5-ol |
| 7567337 |
(4R,5S)-4-methyldecan-5-ol |
| 7567350 |
(1R)-1-cyclopentyl-2,2-dimethyl-propan-1-ol |
| 7567358 |
(3R,5S)-5-ethylnonan-3-ol |
| internal high similarity DBLink | Rows returned: 38 | 1 2 3 4 5 6 7 Next >> |
| active | Cluster 2228 | Additional Members: 18 | Rows returned: 7 | 1 2 Next >> |
|
