| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2005 | 26 | Yes |
Popular Name: 1,3-dimethyl-7-(1-methyl-2-oxo-propyl)-8-[(2-methyl-1-piperidyl)methyl]purine-2,6-dione 1,3-dimethyl-7-(1-methyl-2-oxo-p…
| 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 | 2.04 | -52.73 | 1 | 8 | 1 | 83 | 362.454 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 2.25 | -128.27 | 2 | 8 | 2 | 84 | 363.462 | 4 | ↓ |
