Bioactive Compound Details
| BioID | bio2478 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1928779 |
| Molecular Formula | C8H12N5O4P |
| Molecular Weight | 273.19 |
| Molecular Weight (Monoisotopic) | 273.0627 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar12 |
| Target Name | Toll-like receptor 9 (TLR9) |
| Synonyms | 9-(3-Phosphonopropyl)Guanine |
| Smiles | Nc1nc2c(ncn2CCCP(=O)(O)O)c(=O)[nH]1 |
| Inchi | InChI=1S/C8H12N5O4P/c9-8-11-6-5(7(14)12-8)10-4-13(6)2-1-3-18(15,16)17/h4H,1-3H2,(H2,15,16,17)(H3,9,11,12,14) |
| Inchi Key | KVQSWNOSIROKTE-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 2.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | -0.33 |
| Records Key | ['3c'] |
| Records Name | ['9-(3-phosphonopropyl)guanine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
