| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2004 | 30 | Yes |
Popular Name: 2-[4-(4-chlorophenoxy)butylthio]-5-(p-tolyl)-1H-thieno[2,3-d]pyrimidin-4-one 2-[4-(4-chlorophenoxy)butylthio]…
| 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) | 7.29 | 12.36 | -19.01 | 1 | 4 | 0 | 55 | 457.02 | 8 | ↓ |
| Hi High (pH 8-9.5) | 7.75 | 11.12 | -48.66 | 0 | 4 | -1 | 58 | 456.012 | 8 | ↓ |
