| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2008 | 29 | Yes |
Popular Name: 1,3-dimethyl-8-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-7H-purine-2,6-dione 1,3-dimethyl-8-[2-oxo-2-(4-pheny…
| 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) | 3.37 | 9.32 | -40.49 | 0 | 7 | -1 | 93 | 405.459 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | 10.63 | -25.51 | 1 | 7 | 0 | 90 | 406.467 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.86 | 11.07 | -51.58 | 2 | 7 | 1 | 91 | 407.475 | 5 | ↓ |
