| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (2S,3S)-2-amino-1-[4-[[butyl(methyl)amino]methyl]-1-piperidyl]-3-methyl-pentan-1-one (2S,3S)-2-amino-1-[4-[[butyl(met…
| 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) | 2.39 | 7.74 | -91.99 | 4 | 4 | 2 | 52 | 299.503 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 7.41 | -44.72 | 3 | 4 | 1 | 51 | 298.495 | 8 | ↓ |
