| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2004 | 28 | Yes |
Popular Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-(4-bromophenyl)-2-keto-eth…
| 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) | 6.80 | 9.92 | -45.23 | 0 | 4 | -1 | 66 | 470.393 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 11.65 | -13.12 | 1 | 4 | 0 | 63 | 471.401 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.35 | 11.16 | -16.16 | 1 | 4 | 0 | 63 | 471.401 | 5 | ↓ |
