| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 20 | Yes |
Popular Name: (3S)-1-[(2,4-difluorophenyl)methyl]-3-pyrrolidin-1-yl-piperidine (3S)-1-[(2,4-difluorophenyl)meth…
None
| 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) | 2.82 | 8.34 | -36.16 | 1 | 2 | 1 | 8 | 281.37 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 5.9 | -3.39 | 0 | 2 | 0 | 6 | 280.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 8.39 | -35.08 | 1 | 2 | 1 | 8 | 281.37 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.82 | 10.58 | -108.85 | 2 | 2 | 2 | 9 | 282.378 | 3 | ↓ |
