| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 20 | Yes |
Popular Name: [1-[4-[(isopropylamino)methyl]-2,5-dimethyl-pyrazol-3-yl]-4-piperidyl]methanol [1-[4-[(isopropylamino)methyl]-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) | 1.14 | 4.81 | -37.68 | 3 | 5 | 1 | 58 | 281.424 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 3.61 | -5.88 | 2 | 5 | 0 | 53 | 280.416 | 5 | ↓ |
