| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 19 | Yes |
Popular Name: 3-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]propanenitrile 3-[4-(2,5-dimethylfuran-3-carbon…
| 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) | -0.36 | 4.88 | -13.23 | 0 | 5 | 0 | 60 | 261.325 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.36 | 7.1 | -59.59 | 1 | 5 | 1 | 62 | 262.333 | 3 | ↓ |
