| Compound Information | SONAR Target prediction | | Name: | RETINYL PALMITATE | | Unique Identifier: | SPE01503604 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | | | Molecular Weight: | 464.384 g/mol | | X log p: | 12.918 (online calculus) | | Lipinksi Failures | 2 | | TPSA | 26.3 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 2 | | Rotatable Bond Count: | 21 | | Canonical Smiles: | CCCCCCCCCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C | | Source: | semisynthetic | | Therapeutics: | provitamin, antixerophthalamic |
| Species: |
4932 |
| Condition: |
LAT1 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.6463±0.00933381 |
| Normalized OD Score: sc h |
0.9703±0.0110567 |
| Z-Score: |
-1.4468±0.452243 |
| p-Value: |
0.168509 |
| Z-Factor: |
-2.05303 |
| Fitness Defect: |
1.7808 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | SPECMTS3 | | Plate Number and Position: | 3|D9 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 27.10 Celcius | | Date: | 2008-04-23 YYYY-MM-DD | | Plate CH Control (+): | 0.039875±0.00120 | | Plate DMSO Control (-): | 0.66015±0.01329 | | Plate Z-Factor: | 0.9339 |
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| 5353926 |
[(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] hexadecanoate |
| 5459829 |
[(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] hexadecanoate |
| 6438398 |
[(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] octadecanoate |
| 6440168 |
[(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl]
(E)-octadec-9-enoate |
| 16061316 |
[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl]
(E)-octadec-9-enoate |
| internal high similarity DBLink | Rows returned: 0 | |
| active | Cluster 820 | Additional Members: 15 | Rows returned: 3 | |
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