Bioactive Compound Details
| BioID | bio2068 |
|---|---|
| Name | ABITESARTAN |
| ChEMBL ID | CHEMBL1742401 |
| Molecular Formula | C26H31N5O3 |
| Molecular Weight | 461.57 |
| Molecular Weight (Monoisotopic) | 461.2427 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | ABITESARTAN|TISARTAN |
| Smiles | CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)CC1(C(=O)O)CCCC1 |
| Inchi | InChI=1S/C26H31N5O3/c1-2-3-10-23(32)31(18-26(25(33)34)15-6-7-16-26)17-19-11-13-20(14-12-19)21-8-4-5-9-22(21)24-27-29-30-28-24/h4-5,8-9,11-14H,2-3,6-7,10,15-18H2,1H3,(H,33,34)(H,27,28,29,30) |
| Inchi Key | ZUMPSVPHCDJCMD-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.85 |
| Records Key | ['ABITESARTAN'] |
| Records Name | ['ABITESARTAN'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
