In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2006 | 30 | No |
Popular Name: 4-(2-furylcarbonyl)-3-hydroxy-1-(2-pyridyl)-5-(4-tert-butylphenyl)-5H-pyrrol-2-one 4-(2-furylcarbonyl)-3-hydroxy-1-…
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) | 4.14 | 1.67 | -12.68 | 1 | 6 | 0 | 83 | 402.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 1.51 | -15.32 | 0 | 6 | 0 | 80 | 402.45 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | 1.49 | -49.82 | 2 | 6 | 1 | 84 | 403.458 | 4 | ↓ |