| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 25 | No |
Popular Name: 4-acetyl-3-hydroxy-5-(2-methoxyphenyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one 4-acetyl-3-hydroxy-5-(2-methoxyp…
| 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) | 0.95 | -0.1 | -11.78 | 1 | 6 | 0 | 79 | 338.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | -0.5 | -18.82 | 1 | 6 | 0 | 79 | 338.363 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | -0.34 | -19.9 | 0 | 6 | 0 | 76 | 338.363 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | -0.01 | -45.31 | 2 | 6 | 1 | 80 | 339.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | -0.39 | -46.97 | 2 | 6 | 1 | 80 | 339.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.36 | -0.22 | -52.02 | 1 | 6 | 1 | 77 | 339.371 | 5 | ↓ |
