| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 20 | Yes |
Popular Name: 2-[4-(4-aminobutyl)piperazin-1-yl]-N-cyclopropyl-N-ethyl-acetamide 2-[4-(4-aminobutyl)piperazin-1-y…
| 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) | -0.33 | 4.39 | -100.79 | 4 | 5 | 2 | 56 | 284.448 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.33 | 4.32 | -90.44 | 4 | 5 | 2 | 56 | 284.448 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.33 | 2.22 | -48.05 | 3 | 5 | 1 | 54 | 283.44 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
