| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2010 | 18 | No |
Popular Name: (E)-3-(3-bromo-4-hydroxy-phenyl)-1-(5-chloro-2-thienyl)prop-2-en-1-one (E)-3-(3-bromo-4-hydroxy-phenyl)…
| 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) | 5.03 | 6.84 | -6.49 | 1 | 2 | 0 | 37 | 343.629 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.03 | 7.61 | -37.11 | 0 | 2 | -1 | 40 | 342.621 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
