| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 15 | Yes |
Popular Name: (2S)-2-methyl-1-[(5-methylisoxazol-3-yl)methyl]piperidin-4-one (2S)-2-methyl-1-[(5-methylisoxaz…
| 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) | 0.59 | 3.64 | -9.23 | 0 | 4 | 0 | 46 | 208.261 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.59 | 5.78 | -43.67 | 1 | 4 | 1 | 48 | 209.269 | 2 | ↓ |
