| Compound Information | SONAR Target prediction | | Name: | MENTHOL(-) | | Unique Identifier: | SPE01503134 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 136.106 g/mol | | X log p: | -0.347 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 1 | | Canonical Smiles: | CC(C)C1CCC(C)CC1O | | Class: | terpene | | Source: | Mentha piperita and other Mentha spp | | Therapeutics: | analgesic (topical), antipruritic agent | | 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: |
IRE1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8655±0.00325269 |
| Normalized OD Score: sc h |
1.0009±0.00844047 |
| Z-Score: |
0.5850±0.435709 |
| p-Value: |
0.576812 |
| Z-Factor: |
-6.22198 |
| Fitness Defect: |
0.5502 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Spectrum_ED | | Plate Number and Position: | 1|B3 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 595 nm | | Robot Temperature: | 30.00 Celcius | | Date: | 2010-08-10 YYYY-MM-DD | | Plate CH Control (+): | 0.09475±0.00726 | | Plate DMSO Control (-): | 0.9812500000000001±0.22794 | | Plate Z-Factor: | -0.4294 |
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ps
pdf |
| 7002680 |
(5R,8S,9R,10S,13S,14R,17R)-10,13-dimethyl-17-propyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclo
penta[a]phenanthren-17-ol |
| 7003017 |
(1S,2R,4R)-2,7,7-trimethylnorbornan-2-ol |
| 7003018 |
(1S,2S,4R)-2,7,7-trimethylnorbornan-2-ol |
| 7003191 |
(1S,2S,4S,5R)-4,5-dimethyl-2-[(1R,2S,4S)-1,7,7-trimethylnorbornan-2-yl]cyclohexan-1-ol |
| 7003302 |
(1R,2R,6R)-2-methyl-6-[(1S,2R,4R,6S)-5,5,6-trimethylnorbornan-2-yl]cyclohexan-1-ol |
| 7003969 |
(1R,5R)-bicyclo[3.2.1]octan-1-ol |
| internal high similarity DBLink | Rows returned: 38 | 1 2 3 4 5 6 7 Next >> |
| active | Cluster 4541 | Additional Members: 2 | Rows returned: 0 | |
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