| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 19 | Yes |
Popular Name: [(3S)-1-[(1S,2R)-2-amino-1-(4-fluorophenyl)propyl]-3-piperidyl]methanol [(3S)-1-[(1S,2R)-2-amino-1-(4-fl…
| 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) | 1.44 | 4.44 | -127.76 | 5 | 3 | 2 | 52 | 268.376 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 4.19 | -38.69 | 4 | 3 | 1 | 51 | 267.368 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 2.84 | -44.47 | 4 | 3 | 1 | 51 | 267.368 | 4 | ↓ |
