| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2008 | 30 | Yes |
Popular Name: 8-(4-acetylpiperazin-1-yl)-1,3-dimethyl-7-(p-tolylmethyl)purine-2,6-dione 8-(4-acetylpiperazin-1-yl)-1,3-d…
| 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) | 1.78 | 10.46 | -15.48 | 0 | 9 | 0 | 85 | 410.478 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 10.9 | -44.61 | 1 | 9 | 1 | 87 | 411.486 | 3 | ↓ |
