| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2007 | 33 | Yes |
Popular Name: 3-benzyl-1-[(3,5-dimethyl-1-piperidyl)carbonylmethyl]-7-(2-methoxyethyl)purine-2,6-dione 3-benzyl-1-[(3,5-dimethyl-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) | 2.62 | 1.38 | -18.68 | 0 | 9 | 0 | 91 | 453.543 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 1.73 | -56.04 | 1 | 9 | 1 | 93 | 454.551 | 7 | ↓ |
