Bioactive Compound Details
| BioID | bio197863 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL374151 |
| Molecular Formula | C19H23N5O5 |
| Molecular Weight | 401.42 |
| Molecular Weight (Monoisotopic) | 401.1699 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-Phenylpropoxyadenosine |
| Smiles | Nc1nc(OCCCc2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
| Inchi | InChI=1S/C19H23N5O5/c20-16-13-17(24(10-21-13)18-15(27)14(26)12(9-25)29-18)23-19(22-16)28-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,10,12,14-15,18,25-27H,4,7-9H2,(H2,20,22,23)/t12-,14-,15-,18-/m1/s1 |
| Inchi Key | UDWLAWJOABGYPL-SCFUHWHPSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 7.0 |
| Np Likeness Score | 0.62 |
| Records Key | ['8', '15'] |
| Records Name | ['2-phenylpropoxyadenosine', '2-[6-Amino-2-(3-phenyl-propoxy)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
