In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2007 | 28 | No |
Popular Name: 4-(2-furylcarbonyl)-3-hydroxy-5-(4-methoxyphenyl)-1-(2-pyridyl)-5H-pyrrol-2-one 4-(2-furylcarbonyl)-3-hydroxy-5-…
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) | 2.49 | 7.59 | -67.86 | 0 | 7 | -1 | 96 | 375.36 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 0.5 | -16.11 | 0 | 7 | 0 | 89 | 376.368 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 8.01 | -55.73 | 1 | 7 | 0 | 97 | 376.368 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | 0.89 | -39.63 | 2 | 7 | 1 | 94 | 377.376 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 0.72 | -46.57 | 1 | 7 | 1 | 90 | 377.376 | 5 | ↓ |