| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2006 | 31 | No |
Popular Name: 4-[hydroxy-(p-tolyl)methylene]-5-(2-methoxyphenyl)-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 4-[hydroxy-(p-tolyl)methylene]-5…
| 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) | 3.00 | 9.3 | -61.09 | 0 | 6 | -1 | 83 | 413.453 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 0.21 | -17.09 | 1 | 6 | 0 | 79 | 414.461 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 0.39 | -21.09 | 0 | 6 | 0 | 76 | 414.461 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 0.83 | -40.46 | 2 | 6 | 1 | 80 | 415.469 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 0.32 | -42.07 | 2 | 6 | 1 | 80 | 415.469 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.00 | 8.47 | -14.28 | 1 | 6 | 0 | 80 | 414.461 | 6 | ↓ |
