| 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 | 10.4 | -61.43 | 0 | 5 | -1 | 73 | 401.417 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.57 | 9.98 | -12.91 | 0 | 5 | 0 | 67 | 402.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.60 | 9.35 | -14.84 | 1 | 5 | 0 | 71 | 402.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.57 | 10.26 | -41.5 | 1 | 5 | 1 | 69 | 403.433 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.60 | 9.63 | -39.37 | 2 | 5 | 1 | 72 | 403.433 | 4 | ↓ |
