| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 27 | No |
Popular Name: (4E)-4-[4-[isoamyl(methyl)amino]benzylidene]-1-phenyl-pyrazolidine-3,5-quinone (4E)-4-[4-[isoamyl(methyl)amino]…
| 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) | 3.84 | 10.33 | -9.52 | 1 | 5 | 0 | 58 | 363.461 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.29 | 8.79 | -51.27 | 0 | 5 | -1 | 61 | 362.453 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.84 | 10.79 | -38.71 | 2 | 5 | 0 | 59 | 364.469 | 6 | ↓ |
