| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 3-[[4-(hydroxymethyl)-2,5-dimethyl-pyrazol-3-yl]-isobutyl-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) | 0.68 | 5.02 | -11.62 | 1 | 5 | 0 | 65 | 250.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 5.15 | -34.34 | 2 | 5 | 1 | 66 | 251.354 | 6 | ↓ |
