In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 15 | Yes |
Popular Name: 3-[4-(2-methylpropanoyl)piperazin-1-yl]propanenitrile 3-[4-(2-methylpropanoyl)piperazi…
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) | 0.14 | 3.59 | -12.41 | 0 | 4 | 0 | 47 | 209.293 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.14 | 5.91 | -60.83 | 1 | 4 | 1 | 49 | 210.301 | 3 | ↓ |