| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2008 | 20 | Yes |
Popular Name: 8-(2-diethylaminoethylamino)-3-methyl-7H-purine-2,6-dione 8-(2-diethylaminoethylamino)-3-m…
| 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) | -0.06 | 4.95 | -49.04 | 4 | 8 | 1 | 100 | 281.34 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.40 | 3.64 | -48.32 | 3 | 8 | 0 | 103 | 280.332 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | 2.49 | -11.12 | 3 | 8 | 0 | 99 | 280.332 | 6 | ↓ |
