Bioactive Compound Details
| BioID | bio665 |
|---|---|
| Name | AGELANESIN C |
| ChEMBL ID | CHEMBL598108 |
| Molecular Formula | C18H22Br3N3O2 |
| Molecular Weight | 552.11 |
| Molecular Weight (Monoisotopic) | 548.9262 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Agelanesin C |
| Smiles | CN(C)CCc1ccc(OCCCNC(=O)c2cc(Br)c(Br)[nH]2)c(Br)c1 |
| Inchi | InChI=1S/C18H22Br3N3O2/c1-24(2)8-6-12-4-5-16(13(19)10-12)26-9-3-7-22-18(25)15-11-14(20)17(21)23-15/h4-5,10-11,23H,3,6-9H2,1-2H3,(H,22,25) |
| Inchi Key | GUGUXLUNDIQBBZ-UHFFFAOYSA-N |
| Molecular Species | BASE |
| Targets | 2.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | -0.25 |
| Records Key | ['11'] |
| Records Name | ['Agelanesin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
