| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2008 | 20 | No |
Popular Name: 3-[[4-(chloromethyl)-5-methyl-2-phenyl-pyrazol-3-yl]-methyl-amino]propanenitrile 3-[[4-(chloromethyl)-5-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) | 2.07 | 8.22 | -12.23 | 0 | 4 | 0 | 45 | 288.782 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 8.32 | -34.83 | 1 | 4 | 1 | 46 | 289.79 | 5 | ↓ |
