| Compound Information | SONAR Target prediction | | Name: | EPIANDROSTANEDIOL | | Unique Identifier: | SPE00107093 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C19H32O2 | | Molecular Weight: | 261.21 g/mol | | X log p: | -0.0960000000000001 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 2 | | Rotatable Bond Count: | 0 | | Canonical Smiles: | CC12CCC3C(CCC4CC(O)CCC43C)C1CCC2O | | Source: | ex numerous mammalian tissues | | Therapeutics: | regulation of puberty in females | | 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: |
MRT4 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.3964±0.00459619 |
| Normalized OD Score: sc h |
0.8127±0.0451209 |
| Z-Score: |
-6.1119±0.59355 |
| p-Value: |
0.00000000630146 |
| Z-Factor: |
-1.30782 |
| Fitness Defect: |
18.8825 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 2|G7 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 26.80 Celcius | | Date: | 2007-08-30 YYYY-MM-DD | | Plate CH Control (+): | 0.03949999999999999±0.00059 | | Plate DMSO Control (-): | 0.46475±0.05332 | | Plate Z-Factor: | 0.4602 |
|  png
ps
pdf |
| 7352906 |
n/a |
| 7352936 |
(1R,2R,5S)-5-methyl-2-propyl-cyclohexan-1-ol |
| 7352937 |
(1R,2S,5S)-5-methyl-2-propyl-cyclohexan-1-ol |
| 7352938 |
(1R,2R,5R)-5-methyl-2-propyl-cyclohexan-1-ol |
| 7359279 |
(3S,5S,8R,9R,10S,13R,14S,17S)-17-[(2R,5S)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,1
1,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| 7359280 |
(3S,5S,8R,9R,10S,13R,14S,17S)-17-[(2R,5R)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,1
1,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| internal high similarity DBLink | Rows returned: 38 | 1 2 3 4 5 6 7 Next >> |
| active | Cluster 12674 | Additional Members: 6 | Rows returned: 4 | |
|
