| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: (3S)-3-amino-4-[4-[[isopropyl(methyl)amino]methyl]-1-piperidyl]-4-oxo-butanamide (3S)-3-amino-4-[4-[[isopropyl(me…
| 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) | 0.23 | 1.7 | -88.51 | 6 | 6 | 2 | 95 | 286.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | 1.37 | -46.69 | 5 | 6 | 1 | 94 | 285.412 | 6 | ↓ |
