| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2009 | 23 | Yes |
Popular Name: 4-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]butanenitrile 4-[[5-(4-fluorophenyl)-4-oxo-3H-…
| 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) | 3.84 | 8.36 | -20.56 | 1 | 4 | 0 | 70 | 345.424 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.29 | 7.12 | -44.5 | 0 | 4 | -1 | 73 | 344.416 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.84 | 8.84 | -16.44 | 1 | 4 | 0 | 70 | 345.424 | 5 | ↓ |
