| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2005 | 28 | Yes |
Popular Name: 7-ethyl-3-methyl-8-[4-(p-tolylmethyl)piperazin-1-yl]-purine-2,6-dione 7-ethyl-3-methyl-8-[4-(p-tolylme…
| 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) | 1.59 | 9.75 | -51.32 | 2 | 8 | 1 | 80 | 383.476 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 10.25 | -112.9 | 3 | 8 | 2 | 82 | 384.484 | 4 | ↓ |
