| 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: |
BNI1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.7022±0.0066468 |
| Normalized OD Score: sc h |
1.0005±0.00336044 |
| Z-Score: |
0.0277±0.166801 |
| p-Value: |
0.906146 |
| Z-Factor: |
-14.3745 |
| Fitness Defect: |
0.0986 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum | | Plate Number and Position: | 9|E9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.40 Celcius | | Date: | 2007-09-14 YYYY-MM-DD | | Plate CH Control (+): | 0.04155±0.00083 | | Plate DMSO Control (-): | 0.682925±0.03554 | | Plate Z-Factor: | 0.8228 |
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ps
pdf |
| 18027 |
heptadecan-2-one |
| 18067 |
icosan-3-one |
| 20474 |
2-ethylcyclohexan-1-one |
| 20959 |
2-pentylcyclopentan-1-one |
| 21003 |
2-cyclopentylcyclopentan-1-one |
| 21063 |
1-[(1R,3S)-3-ethyl-2,2-dimethyl-cyclobutyl]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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