| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 20 | Yes |
Popular Name: (3S)-1-[(1S,2S)-2-amino-1-(p-tolyl)propyl]piperidine-3-carboxamide (3S)-1-[(1S,2S)-2-amino-1-(p-tol…
| 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) | 1.08 | 4.07 | -119.47 | 6 | 4 | 2 | 75 | 277.412 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 2.59 | -46.52 | 5 | 4 | 1 | 74 | 276.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 3.76 | -38.22 | 5 | 4 | 1 | 74 | 276.404 | 4 | ↓ |
