| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 27 | Yes |
Popular Name: 8-[[(3R,5S)-3,5-dimethyl-1-piperidyl]methyl]-7-(2-ethoxyethyl)-1,3-dimethyl-purine-2,6-dione 8-[[(3R,5S)-3,5-dimethyl-1-piper…
| 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) | 1.96 | 9.71 | -49.99 | 1 | 8 | 1 | 76 | 378.497 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 10.16 | -128.15 | 2 | 8 | 2 | 77 | 379.505 | 6 | ↓ |
