| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 17 | Yes |
Popular Name: 4-[3,5-dimethyl-4-(propylaminomethyl)pyrazol-1-yl]butanenitrile 4-[3,5-dimethyl-4-(propylaminome…
| 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) | 0.92 | 6.92 | -48.34 | 2 | 4 | 1 | 58 | 235.355 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 5.57 | -12.39 | 1 | 4 | 0 | 54 | 234.347 | 7 | ↓ |
