5-(6-Aminopurin-9-Yl)-2-(Hydroxymethyl)Oxolan-3-Ol
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL416340 | |
| PubChem: | 636 | |
| IUPAC: | 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol | |
| Standard InChI: | InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13) | |
| Standard InChI Key: | OLXZPDWKRNYJJZ-UHFFFAOYSA-N | |
| SMILES: | OCC1OC(CC1O)n1cnc2c1ncnc2N | |
Molecular propeties
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| AlogP: | -0.95 | |
|---|---|---|
| Hydrogen bonds acceptors: | 8 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 3 | |
| Molecular Weight: | 251.1 | |
| Topological polar surface area: | 119 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.5 | |
| Number of carbons: | 10 | |