Bioactive Compound Details
| BioID | bio200087 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL401998 |
| Molecular Formula | C8H13N2O6P |
| Molecular Weight | 264.17 |
| Molecular Weight (Monoisotopic) | 264.0511 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 1-[2-(Phosphonomethoxy)Ethyl]Thymine |
| Smiles | Cc1cn(CCOCP(=O)(O)O)c(=O)[nH]c1=O |
| Inchi | InChI=1S/C8H13N2O6P/c1-6-4-10(8(12)9-7(6)11)2-3-16-5-17(13,14)15/h4H,2-3,5H2,1H3,(H,9,11,12)(H2,13,14,15) |
| Inchi Key | RCQMOSJJIVCPJO-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 3.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | -0.63 |
| Records Key | ['PMET', '2d, PMET'] |
| Records Name | ['1-[2-(phosphonomethoxy)ethyl]thymine', '(2-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy)methylphosphonic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
