Compound Information | SONAR Target prediction | Name: | CHOLESTAN-3-ONE | Unique Identifier: | SPE00270088 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C27H46O | Molecular Weight: | 341.296 g/mol | X log p: | 1.754 (online calculus) | Lipinksi Failures | 0 | TPSA | 17.07 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 1 | Rotatable Bond Count: | 5 | Canonical Smiles: | CC(C)CCCC(C)C1CCC2C3CCC4CC(=O)CCC4(C)C3CCC12C | Source: | ex minor mammalian sterol | 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: |
LCB3 |
Replicates: |
2 |
Raw OD Value: r im |
0.8150±0.000707107 |
Normalized OD Score: sc h |
1.0092±0.00170391 |
Z-Score: |
0.5068±0.104862 |
p-Value: |
0.613274 |
Z-Factor: |
-3.76719 |
Fitness Defect: |
0.4889 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 6|D8 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 27.10 Celcius | Date: | 2006-03-31 YYYY-MM-DD | Plate CH Control (+): | 0.038875±0.00136 | Plate DMSO Control (-): | 0.7859499999999999±0.01197 | Plate Z-Factor: | 0.9545 |
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539264 |
1-(2-methyl-1,2,3,4,5,6,7,7a-octahydroinden-3a-yl)ethanone |
539563 |
4-(5,5-dimethyl-4-spiro[2.5]octyl)butan-2-one |
540017 |
1-cyclododecylpropan-2-one |
541371 |
10,13-dimethyl-17-(6-methylheptan-2-yl)-2-propan-2-yl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocy clopenta[a]phenanthren-3-one |
542961 |
2-cyclohexyl-2-methyl-propanal |
543157 |
3-methylnorcaran-2-one |
internal high similarity DBLink | Rows returned: 17 | 1 2 3 Next >> |
active | Cluster 5819 | Additional Members: 6 | Rows returned: 0 | |
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