| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 28 | Yes |
Popular Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[[2-(4-chlorophenyl)-2-keto-et…
| 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) | 6.67 | 9.82 | -45.35 | 0 | 4 | -1 | 66 | 425.942 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.22 | 11.54 | -13.22 | 1 | 4 | 0 | 63 | 426.95 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.22 | 11.06 | -16.24 | 1 | 4 | 0 | 63 | 426.95 | 5 | ↓ |
