| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2008 | 31 | Yes |
Popular Name: 3-benzyl-1-[(3-chlorophenyl)methyl]-7-isopentyl-purine-2,6-dione 3-benzyl-1-[(3-chlorophenyl)meth…
| 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) | 5.56 | 16.29 | -10.96 | 0 | 6 | 0 | 62 | 436.943 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.56 | 16.8 | -50.74 | 1 | 6 | 1 | 63 | 437.951 | 7 | ↓ |
