| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2009 | 21 | Yes |
Popular Name: 1-methyl-4-[[5-(o-tolyl)-3-pyridyl]methyl]piperazine 1-methyl-4-[[5-(o-tolyl)-3-pyrid…
| 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) | 2.74 | 8.03 | -38 | 1 | 3 | 1 | 21 | 282.411 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 7.91 | -39.99 | 1 | 3 | 1 | 21 | 282.411 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 5.67 | -4.46 | 0 | 3 | 0 | 19 | 281.403 | 3 | ↓ |
