| Compound Information | SONAR Target prediction | | Name: | CAMPHOR (1R) | | Unique Identifier: | SPE01500156 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 136.106 g/mol | | X log p: | -0.875 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 17.07 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 0 | | Canonical Smiles: | CC1(C)C2CCC1(C)C(=O)C2 | | Class: | terpene | | Source: | Cinnamomum camphora | | Therapeutics: | analgesic, antiinfective, antipruritic | | Generic_name: | 5ALPHA-ANDROSTAN-3,17-DIONE | | Chemical_iupac_name: | 5ALPHA-ANDROSTAN-3,17-DIONE | | Drug_type: | Experimental | | Drugbank_id: | EXPT00262 | | Drug_category: | Estradiol 17 Beta-Dehydrogenase 1 inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
SEC66 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.5805±0.00113137 |
| Normalized OD Score: sc h |
1.0218±0.00556049 |
| Z-Score: |
0.8012±0.173628 |
| p-Value: |
0.426524 |
| Z-Factor: |
-2.42023 |
| Fitness Defect: |
0.8521 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 13|B7 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 24.20 Celcius | | Date: | 2007-12-07 YYYY-MM-DD | | Plate CH Control (+): | 0.044325±0.00106 | | Plate DMSO Control (-): | 0.55±0.01014 | | Plate Z-Factor: | 0.9308 |
|  png
ps
pdf |
| 536967 |
n/a |
| 536971 |
4,10,13-trimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]
phenanthren-3-one |
| 536973 |
4-cyclohexylbutan-2-one |
| 536978 |
1-(10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)eth
anone |
| 536986 |
3,6-dimethyloctan-2-one |
| 537088 |
1-(2,2-dimethylcyclopentyl)ethanone |
| internal high similarity DBLink | Rows returned: 17 | 1 2 3 Next >> |
| active | Cluster 10613 | Additional Members: 2 | Rows returned: 0 | |
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