| BioID | bio3232 |
|---|
| Name | AFIMETORAN |
|---|
| ChEMBL ID | CHEMBL4650329 |
|---|
| Molecular Formula | C26H32N6O |
|---|
| Molecular Weight | 444.58 |
|---|
| Molecular Weight (Monoisotopic) | 444.2638 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | AFIMETORAN|BMS 986256|BMS-986256 |
|---|
| Smiles | Cc1c(-c2[nH]c3ccc(C4CCN(CC(N)=O)CC4)cc3c2C(C)C)cn2ncnc2c1C |
|---|
| Inchi | InChI=1S/C26H32N6O/c1-15(2)24-20-11-19(18-7-9-31(10-8-18)13-23(27)33)5-6-22(20)30-25(24)21-12-32-26(28-14-29-32)17(4)16(21)3/h5-6,11-12,14-15,18,30H,7-10,13H2,1-4H3,(H2,27,33) |
|---|
| Inchi Key | SNFVHLQYHFQOEP-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | None |
|---|
| Bioactivities | None |
|---|
| Np Likeness Score | -0.86 |
|---|
| Records Key | ['AFIMETORAN', 'AFIMETORAN'] |
|---|
| Records Name | ['AFIMETORAN', 'AFIMETORAN'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
