| BioID | bio3195 |
|---|
| Name | AN-9 |
|---|
| ChEMBL ID | CHEMBL100014 |
|---|
| Molecular Formula | C10H18O4 |
|---|
| Molecular Weight | 202.25 |
|---|
| Molecular Weight (Monoisotopic) | 202.1205 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | AN-9|Butyric Acid 2,2-Dimethyl-Propionyloxymethyl Ester|Butyric Acid 2,2-Dimethyl-Propionyloxymethyl Ester(An9)|PIVANEX |
|---|
| Smiles | CCCC(=O)OCOC(=O)C(C)(C)C |
|---|
| Inchi | InChI=1S/C10H18O4/c1-5-6-8(11)13-7-14-9(12)10(2,3)4/h5-7H2,1-4H3 |
|---|
| Inchi Key | GYKLFBYWXZYSOW-UHFFFAOYSA-N |
|---|
| Molecular Species | None |
|---|
| Targets | 12.0 |
|---|
| Bioactivities | 25.0 |
|---|
| Np Likeness Score | 0.39 |
|---|
| Records Key | ['AN9', '1a', 'AN-9', 'COVC-0135478846', 'AN-9'] |
|---|
| Records Name | ['Butyric acid 2,2-dimethyl-propionyloxymethyl ester (AN9)', 'Butyric acid 2,2-dimethyl-propionyloxymethyl ester', 'Butyric acid 2,2-dimethyl-propionyloxymethyl ester', 'AN-9', 'AN-9'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
