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 |
| png ps pdf |
166894 |
4-(2,6,6-trimethyl-1-cyclohex-2-enyl)butan-2-ol |
168748 |
(3S,8S,10S,13R,14S,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,5,6,7,8,12,15,16,17-d ecahydro-1H-cyclopenta[a]phenanthren-3-ol |
169478 |
(3S,4R,5S,10S,13S,14R)-4,10,13-trimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dod ecahydro-1H-cyclopenta[a]phenanthren-3-ol |
182433 |
n/a |
183864 |
n/a |
192799 |
(3S,5S,9R,10R,13R,17R)-10,13,14-trimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,5,6,9,11,12,15,16,17-dod ecahydrocyclopenta[a]phenanthren-3-ol |
internal high similarity DBLink | Rows returned: 11 | 1 2 Next >> |
active | Cluster 14237 | Additional Members: 2 | Rows returned: 0 | |
|