| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: (3S)-1-[(1S,2R)-2-amino-1-(p-tolyl)propyl]piperidin-3-ol (3S)-1-[(1S,2R)-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) | 1.34 | 4.44 | -119.44 | 5 | 3 | 2 | 52 | 250.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.34 | 4.2 | -33.13 | 4 | 3 | 1 | 51 | 249.378 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 2.81 | -41.5 | 4 | 3 | 1 | 51 | 249.378 | 3 | ↓ |
