| BioID | bio170239 |
|---|
| Name | RISOVALISIB |
|---|
| ChEMBL ID | CHEMBL4800252 |
|---|
| Molecular Formula | C24H29F3N8O5S |
|---|
| Molecular Weight | 598.61 |
|---|
| Molecular Weight (Monoisotopic) | 598.1934 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar44 |
|---|
| Target Name | None |
|---|
| Synonyms | CYH 33|CYH-33|CYH33|RISOVALISIB |
|---|
| Smiles | COC(=O)Nc1cc(C(F)(F)F)c(-c2nc(N3CCOCC3)c3cc(CN4CCN(S(C)(=O)=O)CC4)cn3n2)cn1 |
|---|
| Inchi | InChI=1S/C24H29F3N8O5S/c1-39-23(36)29-20-12-18(24(25,26)27)17(13-28-20)21-30-22(33-7-9-40-10-8-33)19-11-16(15-35(19)31-21)14-32-3-5-34(6-4-32)41(2,37)38/h11-13,15H,3-10,14H2,1-2H3,(H,28,29,36) |
|---|
| Inchi Key | KTLQDDGRBDLKMN-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 23.0 |
|---|
| Bioactivities | 64.0 |
|---|
| Np Likeness Score | -1.86 |
|---|
| Records Key | ['37; CYH33', 'RISOVALISIB', 'RISOVALISIB'] |
|---|
| Records Name | ['methyl 5-(6-((4-(methylsulfonyl)piperazin-1-yl)methyl)-4-morpholinopyrrolo[1,2-f][1,2,4]triazin-2-yl)-4-(trifluoromethyl)pyridin-2-ylcarbamate', 'RISOVALISIB', 'RISOVALISIB'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
