| BioID | bio198440 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1651381 |
|---|
| Molecular Formula | C11H15N5O4S |
|---|
| Molecular Weight | 313.34 |
|---|
| Molecular Weight (Monoisotopic) | 313.0845 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-MeS-adenosine |
|---|
| Smiles | CSc1nc(N)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |
|---|
| Inchi | InChI=1S/C11H15N5O4S/c1-21-11-14-8(12)5-9(15-11)16(3-13-5)10-7(19)6(18)4(2-17)20-10/h3-4,6-7,10,17-19H,2H2,1H3,(H2,12,14,15)/t4-,6-,7-,10-/m1/s1 |
|---|
| Inchi Key | AJNDEAZTAFKOOO-KQYNXXCUSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | 0.53 |
|---|
| Records Key | ['22, 2-MeS-adenosine', 'MeSAdo'] |
|---|
| Records Name | ['(2R,3R,4S,5R)-2-(6-amino-2-(methylthio)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol', '2-methylthioadenosine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
