| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 15 | Yes |
Popular Name: (2S)-2-amino-1-[(2R)-2-(hydroxymethyl)-1-piperidyl]-3-methyl-butan-1-one (2S)-2-amino-1-[(2R)-2-(hydroxym…
| 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) | -0.09 | 1.85 | -39.96 | 4 | 4 | 1 | 68 | 215.317 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.09 | 1.52 | -5.24 | 3 | 4 | 0 | 67 | 214.309 | 3 | ↓ |
