| BioID | bio2846 |
|---|
| Name | CADRALAZINE |
|---|
| ChEMBL ID | CHEMBL2106561 |
|---|
| Molecular Formula | C12H21N5O3 |
|---|
| Molecular Weight | 283.33 |
|---|
| Molecular Weight (Monoisotopic) | 283.1644 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Phase 2 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | CADRAL|CADRALAZINA|CADRALAZINE |
|---|
| Smiles | CCOC(=O)NNc1ccc(N(CC)CC(C)O)nn1 |
|---|
| Inchi | InChI=1S/C12H21N5O3/c1-4-17(8-9(3)18)11-7-6-10(13-15-11)14-16-12(19)20-5-2/h6-7,9,18H,4-5,8H2,1-3H3,(H,13,14)(H,16,19) |
|---|
| Inchi Key | QLTVVOATEHFXLT-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 62.0 |
|---|
| Bioactivities | 80.0 |
|---|
| Np Likeness Score | -1.67 |
|---|
| Records Key | ['CADRALAZINE', 'SID144206697', 'SID170466021', 'cadralazine', 'CADRALAZINE', 'cadralazine', 'CADRALAZINE', 'cadralazine', 'cadralazine'] |
|---|
| Records Name | ['CADRALAZINE', 'SID144206697', 'SID170466021', 'cadralazine', 'CADRALAZINE', 'cadralazine', 'CADRALAZINE', 'cadralazine', 'cadralazine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
