Bioactive Compound Details
| BioID | bio2431 |
|---|---|
| Name | BLEXIMENIB |
| ChEMBL ID | CHEMBL5314509 |
| Molecular Formula | C32H50FN7O3 |
| Molecular Weight | 599.8 |
| Molecular Weight (Monoisotopic) | 599.3959 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | BLEXIMENIB |
| Smiles | CCN(C(=O)c1cc(F)ccc1Oc1nncnc1N1CCC2(C1)CN([C@H](CCCN(C)CCOC)C(C)C)C2)C(C)C |
| Inchi | InChI=1S/C32H50FN7O3/c1-8-40(24(4)5)31(41)26-18-25(33)11-12-28(26)43-30-29(34-22-35-36-30)38-15-13-32(19-38)20-39(21-32)27(23(2)3)10-9-14-37(6)16-17-42-7/h11-12,18,22-24,27H,8-10,13-17,19-21H2,1-7H3/t27-/m1/s1 |
| Inchi Key | PDUGAXSIWNMIBQ-HHHXNRCGSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -1.46 |
| Records Key | ['BLEXIMENIB'] |
| Records Name | ['BLEXIMENIB'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
