| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 28 | Yes |
Popular Name: 1-(1-benzyl-4-piperidyl)-4-[(4-methylsulfanylphenyl)methyl]piperazine 1-(1-benzyl-4-piperidyl)-4-[(4-m…
| 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) | 3.88 | 11.04 | -37.44 | 1 | 3 | 1 | 11 | 396.624 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 11.01 | -38.81 | 1 | 3 | 1 | 11 | 396.624 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 13.28 | -109.62 | 2 | 3 | 2 | 12 | 397.632 | 6 | ↓ |
