| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2006 | 28 | No |
Popular Name: 1-benzyl-4-(hydroxy-phenyl-methylene)-5-(3-pyridyl)pyrrolidine-2,3-dione 1-benzyl-4-(hydroxy-phenyl-methy…
| 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) | 2.54 | 10.47 | -60.48 | 0 | 5 | -1 | 73 | 369.4 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 9.63 | -12.09 | 1 | 5 | 0 | 71 | 370.408 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 9.98 | -11.65 | 0 | 5 | 0 | 67 | 370.408 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 10.27 | -47.81 | 1 | 5 | 1 | 69 | 371.416 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 9.92 | -41.58 | 2 | 5 | 1 | 72 | 371.416 | 5 | ↓ |
