Bioactive Compound Details
| BioID | bio2295 |
|---|---|
| Name | AGANEPAG |
| ChEMBL ID | CHEMBL2103861 |
| Molecular Formula | C24H31NO4S |
| Molecular Weight | 429.58 |
| Molecular Weight (Monoisotopic) | 429.1974 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | AGANEPAG|AGN-210937 |
| Smiles | CCCCC[C@H](O)c1ccc(N2C(=O)CC[C@@H]2CCCc2ccc(C(=O)O)s2)cc1 |
| Inchi | InChI=1S/C24H31NO4S/c1-2-3-4-8-21(26)17-9-11-19(12-10-17)25-18(13-16-23(25)27)6-5-7-20-14-15-22(30-20)24(28)29/h9-12,14-15,18,21,26H,2-8,13,16H2,1H3,(H,28,29)/t18-,21-/m0/s1 |
| Inchi Key | WXWCSPFQIXPFLD-RXVVDRJESA-N |
| Molecular Species | ACID |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | -0.25 |
| Records Key | ['AGANEPAG'] |
| Records Name | ['AGANEPAG'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
