| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2006 | 31 | No |
Popular Name: 4-benzofuran-2-ylcarbonyl-3-hydroxy-5-(3-pyridyl)-1-(3-pyridylmethyl)-5H-pyrrol-2-one 4-benzofuran-2-ylcarbonyl-3-hydr…
| 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) | 1.87 | 8.59 | -63.8 | 0 | 7 | -1 | 99 | 410.409 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | -1.2 | -29.81 | 1 | 7 | 0 | 96 | 411.417 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | -0.99 | -18.67 | 0 | 7 | 0 | 93 | 411.417 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | -1.08 | -65.69 | 2 | 7 | 1 | 97 | 412.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | -1.08 | -60.46 | 2 | 7 | 1 | 97 | 412.425 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | -0.97 | -115.32 | 3 | 7 | 2 | 99 | 413.433 | 4 | ↓ |
