| BioID | bio1922 |
|---|
| Name | BINODENOSON |
|---|
| ChEMBL ID | CHEMBL1950554 |
|---|
| Molecular Formula | C17H25N7O4 |
|---|
| Molecular Weight | 391.43 |
|---|
| Molecular Weight (Monoisotopic) | 391.1968 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 3 |
|---|
| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | BINODENOSON|Binodenoson|CorVue|MRE-0470|MRE0470|WRC0470 |
|---|
| Smiles | Nc1nc(N/N=C/C2CCCCC2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
|---|
| Inchi | InChI=1S/C17H25N7O4/c18-14-11-15(22-17(21-14)23-20-6-9-4-2-1-3-5-9)24(8-19-11)16-13(27)12(26)10(7-25)28-16/h6,8-10,12-13,16,25-27H,1-5,7H2,(H3,18,21,22,23)/b20-6+/t10-,12-,13-,16-/m1/s1 |
|---|
| Inchi Key | XJFMHMFFBSOEPR-DNZQAUTHSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 11.0 |
|---|
| Bioactivities | 25.0 |
|---|
| Np Likeness Score | 0.42 |
|---|
| Records Key | ['BINODENOSON', '4', '9', '9, WRC-0470, binodenoson', '17, WRC0470', '3, Binodenoson', 'BINODENOSON'] |
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| Records Name | ['BINODENOSON', 'binodenoson', 2-[6-Amino-2-(N'-cyclohexylmethylene-hydrazino)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol", '2-((cyclohexylmethylene)-hydrazino)adenosine', 'Binodenoson', '(2R,3R,4S,5R)-2-(6-Amino-2-((E)-2-(cyclohexylmethylene)hydrazinyl)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol', 'BINODENOSON']" |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
