| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 23 | Yes |
Popular Name: (1R)-1-(2,4-difluorophenyl)-2-[[1-(2-hydroxyethyl)-4-piperidyl]methyl-methyl-amino]ethanol (1R)-1-(2,4-difluorophenyl)-2-[[…
| 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) | 1.58 | 5.59 | -99.17 | 4 | 4 | 2 | 49 | 330.419 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 1.24 | -6.6 | 2 | 4 | 0 | 47 | 328.403 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.26 | -43.33 | 3 | 4 | 1 | 48 | 329.411 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 3.57 | -36.02 | 3 | 4 | 1 | 48 | 329.411 | 7 | ↓ |
