| Compound Information | SONAR Target prediction | | Name: | Beta-Carotene | | Unique Identifier: | LAT006C08 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C40H56 | | Molecular Weight: | 480.428 g/mol | | X log p: | 30.392 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 0 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 0 | | Rotatable Bond Count: | 10 | | Canonical Smiles: | CC1CCCC(C)(C)C=1C=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)
C | | Generic_name: | ALL-TRANS AXEROPHTHENE | | Chemical_iupac_name: | ALL-TRANS AXEROPHTHENE | | Drug_type: | Experimental | | Drugbank_id: | EXPT00602 | | Logp: | 5.62 | | Drug_category: | Retinol Binding Protein Complexed With Axero inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
wt24h |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8068±0.0195161 |
| Normalized OD Score: sc h |
1.0043±0.0172344 |
| Z-Score: |
0.4576±0.612175 |
| p-Value: |
0.676728 |
| Z-Factor: |
-8.42942 |
| Fitness Defect: |
0.3905 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | LATCA | | Plate Number and Position: | 6|C8 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 25.40 Celcius | | Date: | 2007-02-28 YYYY-MM-DD | | Plate CH Control (+): | 0.03945±0.00164 | | Plate DMSO Control (-): | 0.78535±0.01358 | | Plate Z-Factor: | 0.9421 |
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ps
pdf |
| 11147166 |
(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21E,23E,25E,27E,29E,31E,33E)-3,7,11,15,20,24,28,32-octamethyl-1,34-b
is(2,6,6-trimethyl-1-cyclohexenyl)tetratriaconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33-heptadeca
ene |
| 11253876 |
(1E,3E,5E)-3,7-dimethyl-1-(2,6,6-trimethyl-1-cyclohexenyl)octa-1,3,5,7-tetraene |
| 11261360 |
(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-1,18-bis(2,6,6-trimethyl-1-cyclohexenyl)nonadeca-
1,3,5,7,9,11,13,15,17-nonaene |
| 11389688 |
(1R,5R)-4-[(1E)-buta-1,3-dienyl]-7,7-dimethyl-bicyclo[3.1.1]hept-3-ene |
| 11541284 |
(1Z,3Z,5Z,7Z)-1,2,3,4,5,6,7,8-octabutylcycloocta-1,3,5,7-tetraene |
| 11763267 |
(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-1,18-bis(2,6,6-trimethyl-1-cyclohexenyl)-5,6-ditr
itio-octadeca-1,3,5,7,9,11,13,15,17-nonaene |
| internal high similarity DBLink | Rows returned: 1 | |
| active | Cluster 820 | Additional Members: 15 | Rows returned: 3 | |
|
