| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 30 | No |
Popular Name: 5-(3-bromophenyl)-4-[hydroxy-(p-tolyl)methylene]-1-(3-pyridylmethyl)pyrrolidine-2,3-dione 5-(3-bromophenyl)-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) | 3.77 | 10.18 | -60.74 | 0 | 5 | -1 | 73 | 462.323 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 9.69 | -17.06 | 1 | 5 | 0 | 71 | 463.331 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.19 | -0.96 | -13.17 | 0 | 5 | 0 | 67 | 463.331 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.22 | 9.97 | -38.08 | 2 | 5 | 1 | 72 | 464.339 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.19 | -0.85 | -38.04 | 1 | 5 | 1 | 68 | 464.339 | 5 | ↓ |
