| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2008 | 34 | Yes |
Popular Name: 8-(4-allyloxyphenyl)-3-butyl-7-[(2-methoxyphenyl)methyl]purine-2,6-dione 8-(4-allyloxyphenyl)-3-butyl-7-[…
| 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) | 4.91 | 12.81 | -10.37 | 1 | 8 | 0 | 91 | 460.534 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.91 | 13.26 | -35.63 | 2 | 8 | 1 | 92 | 461.542 | 10 | ↓ |
