| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2006 | 26 | Yes |
Popular Name: 1,3-dimethyl-8-[(3-methyl-1-piperidyl)methyl]-7-pentyl-purine-2,6-dione 1,3-dimethyl-8-[(3-methyl-1-pipe…
| 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) | 3.06 | 11.43 | -50.22 | 1 | 7 | 1 | 66 | 362.498 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 11.86 | -127.19 | 2 | 7 | 2 | 68 | 363.506 | 6 | ↓ |
