Compound Information | SONAR Target prediction | Name: | 5alpha-ANDROSTAN-3,17-DIONE | Unique Identifier: | SPE00107108 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 261.21 g/mol | X log p: | -0.364 (online calculus) | Lipinksi Failures | 0 | TPSA | 34.14 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 2 | Rotatable Bond Count: | 0 | Canonical Smiles: | CC12CCC(=O)CC1CCC1C2CCC2(C)C1CCC2=O | Class: | sterol | Source: | human urine & adrenal cortex | Therapeutics: | androgen | Generic_name: | 5ALPHA-ANDROSTAN-3,17-DIONE | Chemical_iupac_name: | 5ALPHA-ANDROSTAN-3,17-DIONE | Drug_type: | Experimental | Drugbank_id: | EXPT00262 | Drug_category: | Estradiol 17 Beta-Dehydrogenase 1 inhibitor | Organisms_affected: | -1 |
Species: |
4932 |
Condition: |
BIK1 |
Replicates: |
2 |
Raw OD Value: r im |
0.6434±0.000777817 |
Normalized OD Score: sc h |
0.9477±0.000183005 |
Z-Score: |
-2.2898±0.0103481 |
p-Value: |
0.0220334 |
Z-Factor: |
-1.67018 |
Fitness Defect: |
3.8152 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 9|A3 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 24.20 Celcius | Date: | 2007-11-08 YYYY-MM-DD | Plate CH Control (+): | 0.039875±0.00091 | Plate DMSO Control (-): | 0.66355±0.02951 | Plate Z-Factor: | 0.8592 |
| png ps pdf |
443 |
10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-dione |
454 |
octanal |
984 |
hexadecanal |
2537 |
1,7,7-trimethylnorbornan-2-one |
6986 |
5-methyl-2-propan-2-yl-cyclohexan-1-one |
7016 |
2-cyclohexylcyclohexan-1-one |
internal high similarity DBLink | Rows returned: 17 | 1 2 3 Next >> |
active | Cluster 11774 | Additional Members: 14 | Rows returned: 5 | |
|