| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 24 | No |
Popular Name: (E)-N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-3-phenyl-prop-2-enamide (E)-N-[6-(4-methylpiperazin-1-yl…
| 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) | 2.73 | 8.28 | -43.57 | 2 | 5 | 1 | 50 | 323.42 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.73 | 5.82 | -11.55 | 1 | 5 | 0 | 48 | 322.412 | 4 | ↓ |
