Bioactive Compound Details
| BioID | bio66 |
|---|---|
| Name | SCHERING C |
| ChEMBL ID | CHEMBL336672 |
| Molecular Formula | C28H37BrN4O3 |
| Molecular Weight | 557.53 |
| Molecular Weight (Monoisotopic) | 556.2049 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Schering C |
| Smiles | CCO/N=C(/c1ccc(Br)cc1)C1CCN(C2(C)CCN(C(=O)c3c(C)cc[n+]([O-])c3C)CC2)CC1 |
| Inchi | InChI=1S/C28H37BrN4O3/c1-5-36-30-26(22-6-8-24(29)9-7-22)23-11-15-32(16-12-23)28(4)13-18-31(19-14-28)27(34)25-20(2)10-17-33(35)21(25)3/h6-10,17,23H,5,11-16,18-19H2,1-4H3/b30-26- |
| Inchi Key | ZGDKVKUWTCGYOA-BXVZCJGGSA-N |
| Molecular Species | BASE |
| Targets | 4.0 |
| Bioactivities | 9.0 |
| Np Likeness Score | -0.46 |
| Records Key | ['1, E-isomer'] |
| Records Name | ['Schering C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
