| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2006 | 30 | No |
Popular Name: 5-(2,5-dimethoxyphenyl)-3-hydroxy-1-isobutyl-4-(4-methylbenzoyl)-5H-pyrrol-2-one 5-(2,5-dimethoxyphenyl)-3-hydrox…
| 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) | 3.99 | 9.74 | -64.07 | 0 | 6 | -1 | 79 | 408.474 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 1.17 | -27.76 | 1 | 6 | 0 | 76 | 409.482 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 1.47 | -19.04 | 0 | 6 | 0 | 72 | 409.482 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
