| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 17 | No |
Popular Name: (E)-4-oxo-4-(3-piperazin-1-ylpropylamino)but-2-enoic (E)-4-oxo-4-(3-piperazin-1-ylpro…
| 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) | -1.22 | 1.13 | -74.57 | 3 | 6 | 0 | 89 | 241.291 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.22 | 3.4 | -142.08 | 4 | 6 | 1 | 90 | 242.299 | 6 | ↓ |
