| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 8th, 2007 | 18 | Yes |
Popular Name: 9-[3-fluoro-5-(hydroxymethyl)tetrahydrofuran-2-yl]purin-6-ol 9-[3-fluoro-5-(hydroxymethyl)tet…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.93 | 1.34 | -26.76 | 2 | 7 | 0 | 93 | 254.221 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | 0.24 | -52.69 | 1 | 7 | -1 | 96 | 253.213 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z100081-3-O | PBMC (Peripheral Blood Mononuclear Cells) (cluster #3 Of 4), Other | Other | 5000 | 0.41 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z100081 | Z100081 | PBMC (Peripheral Blood Mononuclear Cells) | 5000 | 0.41 | Functional ≤ 10μM |
