| BioID | bio3174 |
|---|
| Name | ABIVERTINIB |
|---|
| ChEMBL ID | CHEMBL4297865 |
|---|
| Molecular Formula | C26H26FN7O2 |
|---|
| Molecular Weight | 487.54 |
|---|
| Molecular Weight (Monoisotopic) | 487.2132 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 3 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | A610|ABIVERTINIB|AC-0010|AC0010|ACEA100610|AVITINIB|EX-ACEA0010 |
|---|
| Smiles | C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)c(F)c3)nc3[nH]ccc23)c1 |
|---|
| Inchi | InChI=1S/C26H26FN7O2/c1-3-23(35)29-17-5-4-6-19(15-17)36-25-20-9-10-28-24(20)31-26(32-25)30-18-7-8-22(21(27)16-18)34-13-11-33(2)12-14-34/h3-10,15-16H,1,11-14H2,2H3,(H,29,35)(H2,28,30,31,32) |
|---|
| Inchi Key | UOFYSRZSLXWIQB-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 15.0 |
|---|
| Bioactivities | 92.0 |
|---|
| Np Likeness Score | -1.53 |
|---|
| Records Key | ['Avitinib', 'ABIVERTINIB', 'Avitinib', '10', 'ABIVERTINIB', 'COVC-3907337003', '12b', '93'] |
|---|
| Records Name | ['Avitinib', 'ABIVERTINIB', 'Avitinib', 'N-(3-(2-(3-fluoro-4-(4-methylpiperazin-1-yl)phenylamino)-7H-pyrrolo[2,3-d]pyrimidin-4-yloxy)phenyl)acrylamide', 'ABIVERTINIB', 'ABIVERTINIB', 'Avitinib', 'Abivertinib'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
