| BioID | bio2482 |
|---|
| Name | FABESETRON |
|---|
| ChEMBL ID | CHEMBL2104639 |
|---|
| Molecular Formula | C18H19N3O |
|---|
| Molecular Weight | 293.37 |
|---|
| Molecular Weight (Monoisotopic) | 293.1528 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | FABESETRON |
|---|
| Smiles | Cc1[nH]cnc1C[C@H]1CCc2c(C)c3ccccc3n2C1=O |
|---|
| Inchi | InChI=1S/C18H19N3O/c1-11-14-5-3-4-6-17(14)21-16(11)8-7-13(18(21)22)9-15-12(2)19-10-20-15/h3-6,10,13H,7-9H2,1-2H3,(H,19,20)/t13-/m1/s1 |
|---|
| Inchi Key | AEKQMJRJRAHOAP-CYBMUJFWSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | -0.38 |
|---|
| Records Key | ['FABESETRON', 'SID144206751', 'COVC-3899244060'] |
|---|
| Records Name | ['FABESETRON', 'SID144206751', 'FABESETRON'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
