| BioID | bio228 |
|---|
| Name | TSITSIKAMMAMINE C TRIFLUROACETATE |
|---|
| ChEMBL ID | CHEMBL2153158 |
|---|
| Molecular Formula | C22H18F3N3O4 |
|---|
| Molecular Weight | 445.4 |
|---|
| Molecular Weight (Monoisotopic) | 332.1394 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Tsitsikammamine C Trifluroacetate |
|---|
| Smiles | Cn1cc2c3c1C(=O)c1[nH]cc(-c4ccc(O)cc4)c1C3=[N+](C)CC2.O=C([O-])C(F)(F)F |
|---|
| Inchi | InChI=1S/C20H17N3O2.C2HF3O2/c1-22-8-7-12-10-23(2)19-15(12)18(22)16-14(9-21-17(16)20(19)25)11-3-5-13(24)6-4-11;3-2(4,5)1(6)7/h3-6,9-10H,7-8H2,1-2H3,(H,24,25);(H,6,7) |
|---|
| Inchi Key | XDXDSKAUGRTABH-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | 1.59 |
|---|
| Records Key | ['1'] |
|---|
| Records Name | ['Tsitsikammamine C trifluoroacetate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
