Compound Information | SONAR Target prediction | Name: | CHOLEST-5-EN-3-ONE | Unique Identifier: | SPE01500849 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 340.288 g/mol | X log p: | 3.186 (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)C1CCC2C3CC=C4CC(=O)CCC4(C)C3CCC12C | Class: | sterol | Source: | animal fats; mp 79-80 C | Reference: | J Am Chem Soc 75: 3500 (1953) |
Species: |
4932 |
Condition: |
CHS5 |
Replicates: |
2 |
Raw OD Value: r im |
0.7777±0.0126572 |
Normalized OD Score: sc h |
0.9848±0.0139823 |
Z-Score: |
-0.7469±0.69807 |
p-Value: |
0.507422 |
Z-Factor: |
-10.6843 |
Fitness Defect: |
0.6784 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 8|A8 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 26.70 Celcius | Date: | 2006-03-28 YYYY-MM-DD | Plate CH Control (+): | 0.038625±0.00096 | Plate DMSO Control (-): | 0.7591749999999999±0.01669 | Plate Z-Factor: | 0.9360 |
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11754 |
10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthre n-3-one |
86843 |
13-methyl-1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione |
150901 |
(8S,9S,10R,13R,14S,17S)-17-acetyl-10,13-dimethyl-1,2,4,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]p henanthren-3-one |
160531 |
(8R,9S,10R,13S,14S)-10,13-dimethyl-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17- dione |
166358 |
3,3,5,5-tetramethyl-4,4a,6,7-tetrahydro-1H-naphthalen-2-one |
173107 |
n/a |
internal high similarity DBLink | Rows returned: 1 | |
active | Cluster 17506 | Additional Members: 20 | Rows returned: 3 | |
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