| Compound Information | SONAR Target prediction | | Name: | CEDROL | | Unique Identifier: | SPE00307059 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 197.168 g/mol | | X log p: | 0.0649999999999999 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 0 | | Canonical Smiles: | CC1CCC2C(C)(C)C3CC12CCC3(C)O | | Class: | sesquiterpene | | Source: | Common constitutent in the Family Cupressaceae | | Reference: | J Org Chem 43: 1964 (1978) | | Therapeutics: | acaricide | | Generic_name: | 5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL | | Chemical_iupac_name: | 5-ALPHA-ANDROSTANE-3-BETA,17BETA-DIOL | | Drug_type: | Experimental | | Drugbank_id: | EXPT00530 | | Logp: | 3.73 | | Drug_category: | Sex Hormone-Binding Globulin inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
BNI4 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.5150±0.0221324 |
| Normalized OD Score: sc h |
0.8297±0.0209775 |
| Z-Score: |
-5.3119±1.07016 |
| p-Value: |
0.00000261788 |
| Z-Factor: |
0.202025 |
| Fitness Defect: |
12.8531 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 6|F9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.10 Celcius | | Date: | 2006-03-22 YYYY-MM-DD | | Plate CH Control (+): | 0.03955±0.00070 | | Plate DMSO Control (-): | 0.640825±0.01531 | | Plate Z-Factor: | 0.9537 |
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| 3034119 |
2,3-dimethylheptan-2-ol |
| 3034320 |
(3R,5R)-2-methyl-5-propan-2-yl-bicyclo[3.1.0]hexan-3-ol |
| 3042131 |
5-propyloctan-1-ol |
| 3069674 |
2,2,8,8-tetramethylnonane-1,9-diol |
| 3069679 |
2,9-diethyl-2,9-dimethyl-decane-1,10-diol |
| 3069680 |
2,9-dimethyl-2,9-dipropyl-decane-1,10-diol |
| internal high similarity DBLink | Rows returned: 38 | 1 2 3 4 5 6 7 Next >> |
| active | Cluster 4444 | Additional Members: 3 | Rows returned: 1 | |
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