| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 29 | Yes |
Popular Name: 3-benzyl-1-[(2-chloro-6-fluoro-phenyl)methyl]-7-ethyl-purine-2,6-dione 3-benzyl-1-[(2-chloro-6-fluoro-p…
| 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) | 4.37 | 14.19 | -12.87 | 0 | 6 | 0 | 62 | 412.852 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.37 | 14.7 | -49.43 | 1 | 6 | 1 | 63 | 413.86 | 5 | ↓ |
