| BioID | bio2465 |
|---|
| Name | DORASTINE |
|---|
| ChEMBL ID | CHEMBL2110839 |
|---|
| Molecular Formula | C20H22ClN3 |
|---|
| Molecular Weight | 339.87 |
|---|
| Molecular Weight (Monoisotopic) | 339.1502 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Unknown |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | DORASTINA|DORASTINE|NSC-306726 |
|---|
| Smiles | Cc1ccc(CCn2c3c(c4cc(Cl)ccc42)CN(C)CC3)cn1 |
|---|
| Inchi | InChI=1S/C20H22ClN3/c1-14-3-4-15(12-22-14)7-10-24-19-6-5-16(21)11-17(19)18-13-23(2)9-8-20(18)24/h3-6,11-12H,7-10,13H2,1-2H3 |
|---|
| Inchi Key | WCTGYFWVYBPRGF-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 14.0 |
|---|
| Np Likeness Score | -1.22 |
|---|
| Records Key | ['SID170466641'] |
|---|
| Records Name | ['SID170466641'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
