| BioID | bio2662 |
|---|
| Name | ENDRALAZINE MESYLATE |
|---|
| ChEMBL ID | CHEMBL1980706 |
|---|
| Molecular Formula | C15H19N5O4S |
|---|
| Molecular Weight | 365.42 |
|---|
| Molecular Weight (Monoisotopic) | 269.1277 |
|---|
| Type | Small molecule |
|---|
| Max Phase | Unknown |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 22-708|ENDRALAZINE MESILATE|ENDRALAZINE MESYLATE|ENDRALAZINE METHANESULFONATE|NSC-310289 |
|---|
| Smiles | CS(=O)(=O)O.N/N=c1/cc2c(n[nH]1)CCN(C(=O)c1ccccc1)C2 |
|---|
| Inchi | InChI=1S/C14H15N5O.CH4O3S/c15-16-13-8-11-9-19(7-6-12(11)17-18-13)14(20)10-4-2-1-3-5-10;1-5(2,3)4/h1-5,8H,6-7,9,15H2,(H,16,18);1H3,(H,2,3,4) |
|---|
| Inchi Key | HMVROCAATOPFHB-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 6.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -1.61 |
|---|
| Records Key | ['SID99361060', 'ENDRALAZINE MESYLATE'] |
|---|
| Records Name | ['SID99361060', 'ENDRALAZINE MESYLATE'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | 0 |
|---|
