| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 18 | Yes |
Popular Name: [(3S)-1-[(1R)-2-amino-1-(4-chlorophenyl)ethyl]-3-piperidyl]methanol [(3S)-1-[(1R)-2-amino-1-(4-chlor…
| 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) | 1.55 | 4 | -129.41 | 5 | 3 | 2 | 52 | 270.804 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 3.65 | -38.57 | 4 | 3 | 1 | 51 | 269.796 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 1.89 | -50.19 | 4 | 3 | 1 | 51 | 269.796 | 4 | ↓ |
