| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2007 | 33 | Yes |
Popular Name: 3-benzyl-7-(2-methoxyethyl)-1-[[3-(trifluoromethyl)phenyl]methyl]purine-2,6-dione 3-benzyl-7-(2-methoxyethyl)-1-[[…
| 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) | 4.11 | 3.37 | -11.91 | 0 | 7 | 0 | 71 | 458.44 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 3.72 | -52.81 | 1 | 7 | 1 | 72 | 459.448 | 8 | ↓ |
