| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2011 | 23 | No |
Popular Name: 2-[2-methoxy-4-[(E)-3-(4-methylpiperazin-1-yl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile 2-[2-methoxy-4-[(E)-3-(4-methylp…
| 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) | 1.34 | 5.35 | -18.36 | 0 | 6 | 0 | 66 | 315.373 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 7.69 | -58.14 | 1 | 6 | 1 | 67 | 316.381 | 5 | ↓ |
