| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2006 | 30 | No |
Popular Name: 5-(4-fluorophenyl)-4-[hydroxy-(p-tolyl)methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 5-(4-fluorophenyl)-4-[hydroxy-(p…
| 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) | 3.15 | 9.61 | -59.13 | 0 | 5 | -1 | 73 | 401.417 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 10.03 | -11.65 | 0 | 5 | 0 | 67 | 402.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.60 | 10.05 | -13.41 | 1 | 5 | 0 | 71 | 402.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.57 | 10.33 | -42.25 | 1 | 5 | 1 | 69 | 403.433 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.60 | 10.36 | -40.62 | 2 | 5 | 1 | 72 | 403.433 | 4 | ↓ |
