| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2006 | 28 | Yes |
Popular Name: 3-benzyl-7-(2-furylmethyl)-1-isobutyl-purine-2,6-dione 3-benzyl-7-(2-furylmethyl)-1-iso…
| 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) | 3.63 | 13.17 | -14.38 | 0 | 7 | 0 | 75 | 378.432 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 13.68 | -54.69 | 1 | 7 | 1 | 76 | 379.44 | 6 | ↓ |
