| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 19 | Yes |
Popular Name: (3S)-1-[(1S,2S)-2-amino-1-(4-chlorophenyl)butyl]piperidin-3-ol (3S)-1-[(1S,2S)-2-amino-1-(4-chl…
| 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) | 2.10 | 4.76 | -121.58 | 5 | 3 | 2 | 52 | 284.831 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 4.46 | -37.12 | 4 | 3 | 1 | 51 | 283.823 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 3.3 | -46.09 | 4 | 3 | 1 | 51 | 283.823 | 4 | ↓ |
