| BioID | bio3547 |
|---|
| Name | TENALISIB |
|---|
| ChEMBL ID | CHEMBL4297584 |
|---|
| Molecular Formula | C23H18FN5O2 |
|---|
| Molecular Weight | 415.43 |
|---|
| Molecular Weight (Monoisotopic) | 415.1445 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar18 |
|---|
| Target Name | Serine/threonine-protein kinase cot (COT) |
|---|
| Synonyms | TENALISIB |
|---|
| Smiles | CC[C@H](Nc1ncnc2[nH]cnc12)c1oc2ccccc2c(=O)c1-c1cccc(F)c1 |
|---|
| Inchi | InChI=1S/C23H18FN5O2/c1-2-16(29-23-19-22(26-11-25-19)27-12-28-23)21-18(13-6-5-7-14(24)10-13)20(30)15-8-3-4-9-17(15)31-21/h3-12,16H,2H2,1H3,(H2,25,26,27,28,29)/t16-/m0/s1 |
|---|
| Inchi Key | HDXDQPRPFRKGKZ-INIZCTEOSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | -0.68 |
|---|
| Records Key | ['TENALISIB', 'RP6530', '16; RP6530', '42; RP6530'] |
|---|
| Records Name | ['TENALISIB', 'Tenalisib', 'Tenalisib', 'Tenalisib'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
