| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2006 | 24 | No |
Popular Name: 8-(heptylsulfanyl)-3-methyl-7-(2-methyl-2-propenyl)-3,7-dihydro-1H-purine-2,6-dione 8-(heptylsulfanyl)-3-methyl-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) | 4.11 | -0.38 | -7.02 | 1 | 6 | 0 | 72 | 350.488 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | -0.13 | -35.65 | 2 | 6 | 1 | 73 | 351.496 | 9 | ↓ |
