| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 26th, 2008 | 25 | Yes |
Popular Name: 7-(2-methoxyethyl)-1,3-dimethyl-8-[(4-methyl-1-piperidyl)methyl]purine-2,6-dione 7-(2-methoxyethyl)-1,3-dimethyl-…
| 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) | 1.11 | 8.12 | -51.09 | 1 | 8 | 1 | 76 | 350.443 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 8.58 | -128.55 | 2 | 8 | 2 | 77 | 351.451 | 5 | ↓ |
