| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 21 | Yes |
Popular Name: 2-[4-(3-amino-4-pyridyl)piperazin-1-yl]-N-(2-cyanoethyl)acetamide 2-[4-(3-amino-4-pyridyl)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) | -0.66 | 1.64 | -43.05 | 4 | 7 | 1 | 100 | 289.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.66 | 3.79 | -99.77 | 5 | 7 | 2 | 101 | 290.371 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
