| BioID | bio1627 |
|---|
| Name | RETROFRACTAMIDE C |
|---|
| ChEMBL ID | CHEMBL271630 |
|---|
| Molecular Formula | C20H27NO3 |
|---|
| Molecular Weight | 329.44 |
|---|
| Molecular Weight (Monoisotopic) | 329.1991 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | None |
|---|
| Smiles | CC(C)CNC(=O)/C=C/CCCC/C=C/c1ccc2c(c1)OCO2 |
|---|
| Inchi | InChI=1S/C20H27NO3/c1-16(2)14-21-20(22)10-8-6-4-3-5-7-9-17-11-12-18-19(13-17)24-15-23-18/h7-13,16H,3-6,14-15H2,1-2H3,(H,21,22)/b9-7+,10-8+ |
|---|
| Inchi Key | PAXQNYHJDFKFEU-FIFLTTCUSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 13.0 |
|---|
| Bioactivities | 31.0 |
|---|
| Np Likeness Score | 0.59 |
|---|
| Records Key | ['2', '12', '14, retrofractamide C', '23', '15'] |
|---|
| Records Name | ['Retrofracamide C', 'Retrofractamide C', '(2E,8E)-9-(benzo[d][1,3]dioxol-5-yl)-N-isobutylnona-2,8-dienamide', 'Retrofractamide C', '9-(benzo[d][1,3]dioxol-5-yl)-N-isobutylnona-2,8-dienamide'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
