Compound Information | SONAR Target prediction | Name: | 3-alpha,21-Dihydroxy-5-alpha-pregnan-20-one | Unique Identifier: | LOPAC 01126 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C21H34O3 | Molecular Weight: | 301.231 g/mol | X log p: | -0.154 (online calculus) | Lipinksi Failures | 0 | TPSA | 17.07 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 3 | Rotatable Bond Count: | 2 | Canonical Smiles: | CC12CCC(O)CC1CCC1C3CCC(C(=O)CO)C3(C)CCC12 | Class: | GABA | Action: | Modulator | Selectivity: | GABA-A |
Species: |
4932 |
Condition: |
BY4743 |
Replicates: |
2 |
Raw OD Value: r im |
0.6799±0.00975807 |
Normalized OD Score: sc h |
0.9524±0.0707487 |
Z-Score: |
-1.2597±1.88038 |
p-Value: |
0.47692 |
Z-Factor: |
-6.42775 |
Fitness Defect: |
0.7404 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Lopac | Plate Number and Position: | 12|B8 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 0.00 Celcius | Date: | 2005-08-19 YYYY-MM-DD | Plate CH Control (+): | 0.0514±0.00217 | Plate DMSO Control (-): | 0.6902250000000001±0.03299 | Plate Z-Factor: | 0.9048 |
| png ps pdf |
110894 |
6-hydroxydecan-5-one |
110924 |
7-hydroxydodecan-6-one |
111243 |
1-[(3R,5S,8R,9S,10S,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradec ahydrocyclopenta[a]phenanthren-17-yl]ethanone |
112005 |
2-hydroxy-2,6,6-trimethyl-norpinan-3-one |
158645 |
(2S)-2-hydroxyoctan-3-one |
161209 |
2-hydroxyheptanal |
internal high similarity DBLink | Rows returned: 1 | |
active | Cluster 17389 | Additional Members: 4 | Rows returned: 2 | |
|