| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2008 | 29 | No |
Popular Name: (4E,5S)-4-[hydroxy-(p-tolyl)methylene]-5-phenyl-1-(4-pyridylmethyl)pyrrolidine-2,3-dione (4E,5S)-4-[hydroxy-(p-tolyl)meth…
| 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) | 2.94 | 9.58 | -61.9 | 0 | 5 | -1 | 73 | 383.427 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 10.7 | -11.71 | 0 | 5 | 0 | 67 | 384.435 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 10.71 | -13.21 | 1 | 5 | 0 | 71 | 384.435 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.35 | 10.98 | -42.11 | 1 | 5 | 1 | 69 | 385.443 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 10.99 | -44.94 | 2 | 5 | 1 | 72 | 385.443 | 4 | ↓ |
