| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2006 | 29 | No |
Popular Name: 4-(4-chlorobenzoyl)-5-(4-ethoxyphenyl)-3-hydroxy-1-isobutyl-5H-pyrrol-2-one 4-(4-chlorobenzoyl)-5-(4-ethoxyp…
| 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) | 4.61 | 10.61 | -56.34 | 0 | 5 | -1 | 70 | 412.893 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 0.38 | -25.87 | 1 | 5 | 0 | 66 | 413.901 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 0.59 | -17.56 | 0 | 5 | 0 | 63 | 413.901 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
