| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 19 | No |
Popular Name: (2S)-2-bromo-3-methyl-1-[4-(2-pyridyl)piperazin-1-yl]butan-1-one (2S)-2-bromo-3-methyl-1-[4-(2-py…
| 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) | 2.20 | 6.76 | -39.97 | 1 | 4 | 1 | 38 | 327.246 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.20 | 6.49 | -10.86 | 0 | 4 | 0 | 36 | 326.238 | 3 | ↓ |
