| BioID | bio2029 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1818847 |
|---|
| Molecular Formula | C19H19NO2 |
|---|
| Molecular Weight | 293.37 |
|---|
| Molecular Weight (Monoisotopic) | 293.1416 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 9-Methylheptaphylline |
|---|
| Smiles | CC(C)=CCc1c(O)c(C=O)cc2c3ccccc3n(C)c12 |
|---|
| Inchi | InChI=1S/C19H19NO2/c1-12(2)8-9-15-18-16(10-13(11-21)19(15)22)14-6-4-5-7-17(14)20(18)3/h4-8,10-11,22H,9H2,1-3H3 |
|---|
| Inchi Key | HUOOGLOSOSLEPY-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 1.11 |
|---|
| Records Key | ['Ib'] |
|---|
| Records Name | ['9-Methylheptaphylline'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
