| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 31 | No |
Popular Name: (5S)-4-benzoyl-3-hydroxy-1-[3-(2-hydroxyethylamino)propyl]-5-(3-nitrophenyl)-5H-pyrrol-2-one (5S)-4-benzoyl-3-hydroxy-1-[3-(2…
| 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) | 1.39 | 6.74 | -78.4 | 3 | 9 | 0 | 143 | 425.441 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.39 | 5.25 | -59.72 | 2 | 9 | -1 | 139 | 424.433 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 5.73 | -65.43 | 4 | 9 | 1 | 140 | 426.449 | 9 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 6.7 | -68.94 | 3 | 9 | 1 | 137 | 426.449 | 10 | ↓ |
