| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 31 | Yes |
Popular Name: 3-benzyl-7-cyclopentyl-1-[(2-fluorophenyl)methyl]purine-2,6-dione 3-benzyl-7-cyclopentyl-1-[(2-flu…
| 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) | 4.77 | 15.28 | -11.66 | 0 | 6 | 0 | 62 | 418.472 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.77 | 15.78 | -47.16 | 1 | 6 | 1 | 63 | 419.48 | 5 | ↓ |
