| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 20 | Yes |
Popular Name: 1-[(3R)-3-hydroxybutyl]-3-isobutyl-7H-purine-2,6-dione 1-[(3R)-3-hydroxybutyl]-3-isobut…
| 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) | 1.12 | 4.46 | -12.63 | 2 | 7 | 0 | 93 | 280.328 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | 3.12 | -41.7 | 1 | 7 | -1 | 96 | 279.32 | 5 | ↓ |
