| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 17 | Yes |
Popular Name: [(3S)-1-[(1S)-2-amino-1-phenyl-ethyl]-3-piperidyl]methanol [(3S)-1-[(1S)-2-amino-1-phenyl-e…
| 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) | 0.87 | 3.47 | -120.96 | 5 | 3 | 2 | 52 | 236.359 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 3.76 | -30.64 | 4 | 3 | 1 | 51 | 235.351 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 1.6 | -45.7 | 4 | 3 | 1 | 51 | 235.351 | 4 | ↓ |
