| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 24 | Yes |
Popular Name: 2-[(4-allylpiperazin-1-yl)methyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[3,2-e]pyrimidin-4-one 2-[(4-allylpiperazin-1-yl)methyl…
| 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) | 2.36 | 7.84 | -46.74 | 2 | 5 | 1 | 53 | 345.492 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.74 | -51.54 | 2 | 5 | 1 | 53 | 345.492 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 5.46 | -12.27 | 1 | 5 | 0 | 52 | 344.484 | 4 | ↓ |
