| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2006 | 28 | No |
Popular Name: 4-benzoyl-3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-1-(2-hydroxypropyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-5-(4-hydroxy…
| 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) | 1.45 | 3.08 | -66.08 | 2 | 7 | -1 | 110 | 382.392 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | -3.94 | -29.42 | 3 | 7 | 0 | 107 | 383.4 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | -3.72 | -20.56 | 2 | 7 | 0 | 104 | 383.4 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
