| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 28 | Yes |
Popular Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-keto-2-(p-tolyl)ethyl]thio…
| 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) | 6.45 | 9.98 | -47.87 | 0 | 4 | -1 | 66 | 405.524 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.99 | 11.7 | -13.11 | 1 | 4 | 0 | 63 | 406.532 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.99 | 11.22 | -16.65 | 1 | 4 | 0 | 63 | 406.532 | 5 | ↓ |
