| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 20 | No |
Popular Name: (E)-3-[4-(4-methylpiperazine-1-carbonyl)phenyl]prop-2-enoic (E)-3-[4-(4-methylpiperazine-1-c…
| 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) | 0.77 | 7.18 | -81.24 | 1 | 5 | 0 | 65 | 274.32 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 4.78 | -50.49 | 0 | 5 | -1 | 64 | 273.312 | 3 | ↓ |
