| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2007 | 27 | Yes |
Popular Name: 7-benzyl-1-[(4-chlorophenyl)methyl]-3-methyl-purine-2,6-dione 7-benzyl-1-[(4-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) | 3.93 | 1.54 | -11.05 | 0 | 6 | 0 | 61 | 380.835 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 1.82 | -49.63 | 1 | 6 | 1 | 63 | 381.843 | 4 | ↓ |
