| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 15 | No |
Popular Name: (E)-4-(3-chloro-4-hydroxy-5-methoxy-phenyl)but-3-en-2-one (E)-4-(3-chloro-4-hydroxy-5-meth…
| 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) | 2.38 | 4.01 | -8.48 | 1 | 3 | 0 | 47 | 226.659 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.38 | 4.93 | -43.1 | 0 | 3 | -1 | 49 | 225.651 | 3 | ↓ |
