| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2007 | 32 | Yes |
Popular Name: 3-benzyl-7-(2-methoxyethyl)-1-[(4-methyl-1-piperidyl)carbonylmethyl]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) | 2.14 | 0.65 | -19.36 | 0 | 9 | 0 | 91 | 439.516 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 1 | -58.08 | 1 | 9 | 1 | 93 | 440.524 | 7 | ↓ |
