| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | Yes |
Popular Name: (2S)-2-methyl-3-[4-(4-pyridylmethyl)piperazin-1-yl]propan-1-amine (2S)-2-methyl-3-[4-(4-pyridylmet…
| 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) | -0.11 | 3.86 | -95.67 | 4 | 4 | 2 | 48 | 250.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 3.57 | -107.8 | 4 | 4 | 2 | 48 | 250.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.11 | 1.6 | -44.98 | 3 | 4 | 1 | 47 | 249.382 | 5 | ↓ |
