| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 14 | Yes |
Popular Name: 4-[4-(aminomethyl)-3,5-dimethyl-pyrazol-1-yl]butanenitrile 4-[4-(aminomethyl)-3,5-dimethyl-…
| 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) | -0.33 | 3.39 | -53.27 | 3 | 4 | 1 | 69 | 193.274 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.33 | 2.99 | -13.83 | 2 | 4 | 0 | 68 | 192.266 | 4 | ↓ |
