| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 30th, 2008 | 32 | Yes |
Popular Name: 3-benzyl-7-cyclopentyl-1-[(3-methoxyphenyl)methyl]purine-2,6-dione 3-benzyl-7-cyclopentyl-1-[(3-met…
| 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) | 4.68 | 14.53 | -11.48 | 0 | 7 | 0 | 71 | 430.508 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.68 | 15.04 | -48.04 | 1 | 7 | 1 | 72 | 431.516 | 6 | ↓ |
