| Compound Information | SONAR Target prediction | | Name: | 3-ethylenedioxy-17-beta-hydroxyandrostane | | Unique Identifier: | NRB 03720 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C21H34O3 | | Molecular Weight: | 301.231 g/mol | | X log p: | 0.253 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 18.46 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 3 | | Rotatable Bond Count: | 0 | | Canonical Smiles: | CC12CCC3C(CCC4CC5(CCC43C)OCCO5)C1CCC2O |
| Species: |
4932 |
| Condition: |
GIM3 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7188±0.0286378 |
| Normalized OD Score: sc h |
0.9051±0.00758089 |
| Z-Score: |
-5.0425±0.406856 |
| p-Value: |
0.00000104241 |
| Z-Factor: |
0.497353 |
| Fitness Defect: |
13.774 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | Maybridge1000 | | Plate Number and Position: | 8|D8 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 21.80 Celcius | | Date: | 2007-08-23 YYYY-MM-DD | | Plate CH Control (+): | 0.042±0.00209 | | Plate DMSO Control (-): | 0.792225±0.00653 | | Plate Z-Factor: | 0.9597 |
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| 11450468 |
(3R,8R,9S,10S,13S,14S)-10,13-dimethylspiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]p
henanthrene-17,2--1,3-dioxolane]-3-ol |
| 11775816 |
(3aR,7aS)-3a,7,7-trimethylspiro[1,2,4,5,6,7a-hexahydroindene-3,2--1,3-dioxolane] |
| 11776038 |
(2S)-10-(1,3-dioxolan-2-yl)decan-2-ol |
| 15966469 |
n/a |
| internal high similarity DBLink | Rows returned: 3 | |
| nonactive | Cluster 12674 | Additional Members: 6 | Rows returned: 4 | |
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