In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2005 | 28 | No |
Popular Name: 4-benzofuran-2-ylcarbonyl-3-hydroxy-1-(2-methoxyethyl)-5-(3-pyridyl)-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) | 1.69 | -1.27 | -15.97 | 1 | 7 | 0 | 92 | 378.384 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.11 | -1.45 | -23.13 | 0 | 7 | 0 | 89 | 378.384 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.14 | -1.54 | -67.79 | 2 | 7 | 1 | 94 | 379.392 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.11 | -1.33 | -54.62 | 1 | 7 | 1 | 90 | 379.392 | 6 | ↓ |