| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2005 | 22 | No |
Popular Name: 4-acetyl-3-hydroxy-1-[2-(2-hydroxyethylamino)ethyl]-5-(3-pyridyl)-5H-pyrrol-2-one 4-acetyl-3-hydroxy-1-[2-(2-hydro…
| 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) | -1.66 | -4.39 | -55.09 | 4 | 7 | 1 | 107 | 306.342 | 7 | ↓ |
| Mid Mid (pH 6-8) | -2.24 | -4.62 | -69.02 | 3 | 7 | 1 | 104 | 306.342 | 7 | ↓ |
| Mid Mid (pH 6-8) | -1.66 | -4.69 | -61.07 | 4 | 7 | 1 | 107 | 306.342 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -1.66 | -4.3 | -113.52 | 5 | 7 | 2 | 108 | 307.35 | 6 | ↓ |
