| Compound Information | SONAR Target prediction | | Name: | LATHOSTEROL | | Unique Identifier: | SPE01500843 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 341.296 g/mol | | X log p: | 3.679 (online calculus) | | Lipinksi Failures | 0 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 1 | | Rotatable Bond Count: | 5 | | Canonical Smiles: | CC(C)CCCC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC12C | | Class: | sterol | | Source: | Austeria rubens | | Reference: | J Biol Chem 248: 6697 (1973) | | Generic_name: | LANOSTEROL | | Chemical_iupac_name: | LANOSTEROL | | Drug_type: | Experimental | | Kegg_compound_id: | C01724 | | Drugbank_id: | EXPT02002 | | Logp: | 7.63 | | Cas_registry_number: | 79-63-0 | | Drug_category: | Lanosterol Synthase inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
RGP1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.3965±0.00622254 |
| Normalized OD Score: sc h |
0.8229±0.0199773 |
| Z-Score: |
-4.6220±0.459677 |
| p-Value: |
0.00000903334 |
| Z-Factor: |
0.0289704 |
| Fitness Defect: |
11.6146 |
| Bioactivity Statement: |
Active |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 22|A3 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 26.50 Celcius | | Date: | 2008-06-26 YYYY-MM-DD | | Plate CH Control (+): | 0.040025±0.00027 | | Plate DMSO Control (-): | 0.4675±0.01743 | | Plate Z-Factor: | 0.8726 |
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| 6428994 |
2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]propan-2-ol |
| 6429138 |
(1R,3aS)-3a,6-dimethyl-1-propan-2-yl-2,3,4,7,8,8a-hexahydroazulen-1-ol |
| 6429378 |
2-[(8R,8aS)-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-2-yl]propan-2-ol |
| 6431158 |
(3R,5R)-17-(1-hydroxyethyl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phe
nanthren-3-ol |
| 6431160 |
(3R,5R)-17-(1-hydroxyethyl)-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phe
nanthren-3-ol |
| 6431456 |
(8R)-2,5-dimethyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydro-1H-naphthalen-2-ol |
| internal high similarity DBLink | Rows returned: 11 | 1 2 Next >> |
| active | Cluster 14237 | Additional Members: 2 | Rows returned: 0 | |
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