| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 21 | Yes |
Popular Name: 2-[4-(3-aminopropyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide 2-[4-(3-aminopropyl)piperazin-1-…
| 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) | 0.64 | 3.3 | -112.35 | 5 | 5 | 2 | 64 | 296.39 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | 0.97 | -51.4 | 4 | 5 | 1 | 63 | 295.382 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.64 | 0.64 | -9.32 | 3 | 5 | 0 | 62 | 294.374 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 2.92 | -40.2 | 4 | 5 | 1 | 63 | 295.382 | 6 | ↓ |
