| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 35 | No |
Popular Name: (E)-N-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-N-isobutyl-3-(4-nitrophenyl)prop-2-enamide (E)-N-[3-(4-benzylpiperazin-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) | 4.01 | 13.14 | -18.48 | 0 | 8 | 0 | 90 | 478.593 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 15.57 | -56.46 | 1 | 8 | 1 | 91 | 479.601 | 10 | ↓ |
