| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 15 | Yes |
Popular Name: 3-[[4-(hydroxymethyl)-2,5-dimethyl-pyrazol-3-yl]-methyl-amino]propanenitrile 3-[[4-(hydroxymethyl)-2,5-dimeth…
| 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) | -0.44 | 1.11 | -37.08 | 2 | 5 | 1 | 66 | 209.273 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.44 | 1 | -14.42 | 1 | 5 | 0 | 65 | 208.265 | 4 | ↓ |
