| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2008 | 24 | Yes |
Popular Name: 8-(allylamino)-7-[(2-chlorophenyl)methyl]-3-methyl-purine-2,6-dione 8-(allylamino)-7-[(2-chloropheny…
| 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) | 2.10 | 9.17 | -7.43 | 2 | 7 | 0 | 85 | 345.79 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.10 | 9.6 | -33.27 | 3 | 7 | 1 | 86 | 346.798 | 5 | ↓ |
