| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 16 | Yes |
Popular Name: (2S,3S)-2-amino-1-[4-(hydroxymethyl)-1-piperidyl]-3-methyl-pentan-1-one (2S,3S)-2-amino-1-[4-(hydroxymet…
| 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) | 0.29 | 1.16 | -45.32 | 4 | 4 | 1 | 68 | 229.344 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.29 | 0.72 | -9.38 | 3 | 4 | 0 | 67 | 228.336 | 4 | ↓ |
