| BioID | bio2470 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1229838 |
|---|
| Molecular Formula | C9H14N5O5P |
|---|
| Molecular Weight | 303.22 |
|---|
| Molecular Weight (Monoisotopic) | 303.0733 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | 9-[2-(Phosphonoethoxy)Ethyl]Guanine |
|---|
| Smiles | Nc1nc2c(ncn2CCOCCP(=O)(O)O)c(=O)[nH]1 |
|---|
| Inchi | InChI=1S/C9H14N5O5P/c10-9-12-7-6(8(15)13-9)11-5-14(7)1-2-19-3-4-20(16,17)18/h5H,1-4H2,(H2,16,17,18)(H3,10,12,13,15) |
|---|
| Inchi Key | KDWYBFCNTYIRFX-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | -0.52 |
|---|
| Records Key | ['1', '11', 'PEE, PEEG', 'PEEG'] |
|---|
| Records Name | ['2-(2-(2-amino-6-oxo-1H-purin-9(6H)-yl)ethoxy)ethylphosphonic acid', '2-(2-(2-amino-6-oxo-1H-purin-9(6H)-yl)ethoxy)ethylphosphonic acid', '2-(2-(2-amino-6-oxo-1H-purin-9(6H)-yl)ethoxy)ethylphosphonic acid', '9-[2-(phosphonoethoxy)ethyl]guanine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
