Compound Information | SONAR Target prediction | Name: | CHOLESTAN-3beta,5alpha,6beta-TRIOL | Unique Identifier: | SPE00270090 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 372.287 g/mol | X log p: | -0.645 (online calculus) | Lipinksi Failures | 0 | TPSA | 0 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 3 | Rotatable Bond Count: | 5 | Canonical Smiles: | CC(C)CCCC(C)C1CCC2C3C(O)CC4(O)CC(O)CCC4(C)C3CCC12C | Class: | sterol | Source: | Pteroeides esperi | Reference: | Indian J Chem Soc B 14: 802 (1976) |
Species: |
4932 |
Condition: |
YPT6 |
Replicates: |
2 |
Raw OD Value: r im |
0.2570±0.00141421 |
Normalized OD Score: sc h |
0.5022±0.00746613 |
Z-Score: |
-13.9175±0.190918 |
p-Value: |
1.65353e-43 |
Z-Factor: |
0.764239 |
Fitness Defect: |
98.5082 |
Bioactivity Statement: |
Active |
Experimental Conditions | | Library: | SPECMTS3 | Plate Number and Position: | 13|E7 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.60 Celcius | Date: | 2008-06-05 YYYY-MM-DD | Plate CH Control (+): | 0.0407±0.00049 | Plate DMSO Control (-): | 0.512175±0.01640 | Plate Z-Factor: | 0.8807 |
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346449 |
4-cyclohexylcyclohexane-1,3-diol |
380800 |
(3S)-2,2,5,5-tetramethylcyclohexane-1,3-diol |
429306 |
5-methyladamantane-1,3-diol |
495694 |
2,2,5,5-tetramethylcyclohexane-1,3-diol |
520126 |
2,2,4,4,6,6-hexamethylcyclohexane-1,3,5-triol |
522957 |
2,6-bis(hydroxymethyl)-4-methyl-cyclohexan-1-ol |
internal high similarity DBLink | Rows returned: 6 | |
active | Cluster 17506 | Additional Members: 20 | Rows returned: 3 | |
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