| BioID | bio2653 |
|---|
| Name | BUTANSERIN |
|---|
| ChEMBL ID | CHEMBL1742433 |
|---|
| Molecular Formula | C24H26FN3O3 |
|---|
| Molecular Weight | 423.49 |
|---|
| Molecular Weight (Monoisotopic) | 423.1958 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | BUTANSERIN|BUTANSERINA|BUTANSERINE |
|---|
| Smiles | O=C(c1ccc(F)cc1)C1CCN(CCCCn2c(=O)[nH]c3ccccc3c2=O)CC1 |
|---|
| Inchi | InChI=1S/C24H26FN3O3/c25-19-9-7-17(8-10-19)22(29)18-11-15-27(16-12-18)13-3-4-14-28-23(30)20-5-1-2-6-21(20)26-24(28)31/h1-2,5-10,18H,3-4,11-16H2,(H,26,31) |
|---|
| Inchi Key | MLDQSYUQSLUEPG-UHFFFAOYSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | -1.32 |
|---|
| Records Key | ['BUTANSERIN', 'COVC-0140847487'] |
|---|
| Records Name | ['BUTANSERIN', 'BUTANSERIN'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
