| BioID | bio1421 |
|---|
| Name | PSAMMAPLYSENE C |
|---|
| ChEMBL ID | CHEMBL400771 |
|---|
| Molecular Formula | C28H38Br3N3O3 |
|---|
| Molecular Weight | 704.34 |
|---|
| Molecular Weight (Monoisotopic) | 701.0463 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | psammaplysene C |
|---|
| Smiles | CN(C)CCCOc1ccc(/C=C/C(=O)N(C)CCCOc2c(Br)cc(CCN(C)C)cc2Br)cc1Br |
|---|
| Inchi | InChI=1S/C28H38Br3N3O3/c1-32(2)13-6-16-36-26-10-8-21(18-23(26)29)9-11-27(35)34(5)14-7-17-37-28-24(30)19-22(20-25(28)31)12-15-33(3)4/h8-11,18-20H,6-7,12-17H2,1-5H3/b11-9+ |
|---|
| Inchi Key | AWJCEHBDNXBPBM-PKNBQFBNSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | -0.24 |
|---|
| Records Key | ['1, psammaplysene C'] |
|---|
| Records Name | ['(2E)-3-{3-bromo-4-[3-(dimethylamino)propoxy]phenyl}-N-(3-{2,6-dibromo-4-[2-(dimethylamino)ethyl]phenoxy}propyl)-N-methylacrylamide'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
