| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 34 | No |
Popular Name: 4-(4-butoxy-3-methyl-benzoyl)-3-hydroxy-1-(2-methoxyethyl)-5-(4-nitrophenyl)-5H-pyrrol-2-one 4-(4-butoxy-3-methyl-benzoyl)-3-…
| 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) | 4.19 | 10.93 | -54.01 | 0 | 9 | -1 | 125 | 467.498 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.61 | 10.93 | -20.7 | 0 | 9 | 0 | 119 | 468.506 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.64 | 9.89 | -28.56 | 1 | 9 | 0 | 122 | 468.506 | 10 | ↓ |
