| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 27th, 2006 | 30 | No |
Popular Name: 4-[hydroxy-(p-tolyl)methylene]-1-phenethyl-5-(3-pyridyl)pyrrolidine-2,3-dione 4-[hydroxy-(p-tolyl)methylene]-1…
| 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) | 3.39 | 10.99 | -41.77 | 0 | 5 | -1 | 73 | 397.454 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.81 | 11.5 | -24.5 | 0 | 5 | 0 | 67 | 398.462 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | 10.8 | -14.33 | 1 | 5 | 0 | 71 | 398.462 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.81 | 11.79 | -59.83 | 1 | 5 | 1 | 69 | 399.47 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.39 | 11.09 | -46.26 | 2 | 5 | 1 | 72 | 399.47 | 6 | ↓ |
