| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2008 | 25 | Yes |
Popular Name: 8-(diethylaminomethyl)-1-hexyl-3,7-dimethyl-purine-2,6-dione 8-(diethylaminomethyl)-1-hexyl-3…
| 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) | 3.17 | 11.18 | -47.19 | 1 | 7 | 1 | 66 | 350.487 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 11.63 | -117.91 | 2 | 7 | 2 | 68 | 351.495 | 9 | ↓ |
