| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 24 | Yes |
Popular Name: 1-butyl-3-(3-hydroxybutyl)-7-(2-hydroxypropyl)purine-2,6-dione 1-butyl-3-(3-hydroxybutyl)-7-(2-…
| 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) | 1.23 | 6.18 | -12.14 | 2 | 8 | 0 | 102 | 338.408 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | 6.66 | -48.64 | 3 | 8 | 1 | 104 | 339.416 | 8 | ↓ |
