| 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: |
MDH1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7646±0.05572 |
| Normalized OD Score: sc h |
1.0122±0.0303168 |
| Z-Score: |
0.6010±1.66019 |
| p-Value: |
0.3213 |
| Z-Factor: |
-16.1986 |
| Fitness Defect: |
1.1354 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 9|E9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.70 Celcius | | Date: | 2007-08-07 YYYY-MM-DD | | Plate CH Control (+): | 0.040275±0.00081 | | Plate DMSO Control (-): | 0.7285499999999999±0.02909 | | Plate Z-Factor: | 0.9073 |
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ps
pdf |
| 84399 |
3,3,5,5-tetramethylcyclohexan-1-one |
| 84467 |
undecan-4-one |
| 84532 |
(1S,2S,5R)-2,6,6-trimethylnorpinan-3-one |
| 84611 |
n/a |
| 85783 |
1-(3,3,5-trimethylcyclohexyl)ethanone |
| 85881 |
10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phe
nanthren-3-one |
| internal high similarity DBLink | Rows returned: 17 | 1 2 3 Next >> |
| active | Cluster 10613 | Additional Members: 2 | Rows returned: 0 | |
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